SMILES for Phosphatidylinositol 3-kinase catalytic subunit type 3

1277 SMILES Strings for Phosphatidylinositol 3-kinase catalytic subunit type 3

Compound Name

SMILES String

BDBM50156299

C(C1CC1)c1nc(NC2CCOCC2)ncc1-c1ccnc(Nc2ccncc2)n1

BDBM50156301

C(C1CC1)c1ncncc1-c1ccnc(Nc2ccncc2)n1

BDBM50156295

C(Nc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccncc2)n1)c1ccccc1

BDBM50156383

CC(=O)N1CCN(CC1)[C@H]1C[C@H](C1)n1cc(-c2cc(OC[C@@H]3CCCO3)ccc2F)c2c(N)ncnc12 |r,wU:21.22,wD:11.14,9.9,(4.28,-11.46,;5,-10.46,;6.22,-10.59,;4.36,-9.06,;2.83,-8.9,;2.2,-7.5,;3.1,-6.26,;4.64,-6.41,;5.27,-7.81,;2.74,-4.76,;3.54,-3.45,;2.24,-2.7,;1.42,-3.96,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;5.86,4.56,;6.43,5.99,;7.96,6.21,;9.01,5.1,;10.39,5.78,;10.17,7.31,;8.66,7.57,;3.38,5.55,;1.86,5.34,;1.29,3.91,;.07,3.74,;.3,.77,;-1.03,1.55,;-1.03,2.79,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,)|

BDBM337954

CC(=O)Nc1cc(c(C)cn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(C)cc2F)c1

BDBM338001

CC(=O)Nc1cc(c(C)cn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM338075

CC(=O)Nc1cc(c(C)cn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2F)c1C

BDBM337873

CC(=O)Nc1cc(c(C)cn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1

BDBM338250

CC(=O)Nc1cc(c(C)cn1)-c1cnc(Cl)c(c1)C(=O)N1CCC1

BDBM338034

CC(=O)Nc1cc(c(C)cn1)-c1cnc2[nH]ncc2c1

BDBM337985

CC(=O)Nc1cc(c(F)cn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM346196

CC(=O)Nc1cc(c(F)cn1)-c1cncc2n(ccc12)S(=O)(=O)C1CC1

BDBM338230

CC(=O)Nc1cc(cc(C)n1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM338044

CC(=O)Nc1cc(cc[n+]1[O-])-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM338083

CC(=O)Nc1cc(ccn1)-c1cc(NS(=O)(=O)c2ccc(F)cc2F)c(C)[n+]([O-])c1

BDBM338220

CC(=O)Nc1cc(ccn1)-c1cc(NS(=O)(=O)c2ccc(F)cc2F)c2ccnn2c1

BDBM338160

CC(=O)Nc1cc(ccn1)-c1cc(NS(=O)(=O)c2ccc(F)cc2F)c2ncnn2c1

BDBM532964

CC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1ccccc1C(F)(F)F

BDBM532955

CC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1ccccc1Cl

BDBM532966

CC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1cccnc1C

BDBM532965

CC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1cccnc1C(F)(F)F

BDBM532967

CC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1cnccc1C

BDBM532968

CC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1cscc1C(F)(F)F

BDBM532959

CC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)N1CCCCC1C(F)(F)F

BDBM532961

CC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)N1CCOCC1C(F)(F)F

BDBM532963

CC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)N1CCOCC1C1CC1

BDBM338015

CC(=O)Nc1cc(ccn1)-c1cc(c[n+]([O-])c1)S(C)(=O)=O

BDBM352747

CC(=O)Nc1cc(ccn1)-c1ccc(Cl)c(c1)S(=O)(=O)N[C@H](CO)c1ccccc1 |r|

BDBM337905

CC(=O)Nc1cc(ccn1)-c1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM338227

CC(=O)Nc1cc(ccn1)-c1cnc(C#N)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM337934

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NC(=O)c2ccc(F)cc2F)c1

BDBM338017

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NC(C)=O)c1

BDBM337933

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)C2CC2)c1

BDBM352856

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)C2CC3CCC2C3)c1

BDBM337889

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)C2CCCCC2)c1

BDBM338228

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)CC(F)F)c1

BDBM338261

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)N2CC3CCC2C3)c1

BDBM338298

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)N2CCC(C)(C)CC2)c1

BDBM338193

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)N2CCC(F)(F)CC2)c1

BDBM338082

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)N2CCC2)c1

BDBM338098

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)N2CCCC2)c1

BDBM338039

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)N2CCCCC2)c1

BDBM338163

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)N2CCCCCC2)c1

BDBM338263

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)N2CCOCC2)c1

BDBM338277

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2c(Cl)cccc2Cl)c1

BDBM337974

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2c(F)cccc2F)c1

BDBM338002

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cc(C)ccc2C)c1

BDBM337845

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cc(C)ccc2F)c1

BDBM337930

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1

BDBM338280

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cc(Cl)sc2Cl)c1

BDBM337869

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cc(F)ccc2F)c1

BDBM337967

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cc(ccc2F)C(F)(F)F)c1

BDBM337899

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(C)cc2)c1

BDBM337952

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(C)cc2Cl)c1

BDBM338006

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(C)cc2F)c1

BDBM337978

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(Cl)cc2)c1

BDBM337847

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1

BDBM337913

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(Cl)cc2F)c1

BDBM337876

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)c(F)c2)c1

BDBM338009

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2)c1

BDBM338030

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1

BDBM337858

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM338072

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1C

BDBM337932

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)c1

BDBM337955

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c1

BDBM337909

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(cc2)C(F)(F)F)c1

BDBM338020

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(cc2Cl)C(F)(F)F)c1

BDBM338176

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(cc2F)C#N)c1

BDBM337817

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(nc2)C(F)(F)F)c1

BDBM338159

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccc(C)c2F)c1

BDBM338164

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccc(Cl)c2Cl)c1

BDBM337979

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccc(F)c2)c1

BDBM338144

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccc(F)c2Cl)c1

BDBM338196

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccc(F)c2F)c1

BDBM337887

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccc(c2)C(C)(C)C)c1

BDBM337992

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccc(c2)C(F)(F)F)c1

BDBM337897

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccc3ccccc23)c1

BDBM337903

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccccc2)c1

BDBM337879

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccccc2C(F)(F)F)c1

BDBM338036

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccccc2C)c1

BDBM337928

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccccc2Cl)c1

BDBM337968

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccccc2F)c1

BDBM337862

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccnc2)c1

BDBM338027

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccsc2)c1

BDBM337835

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)c1

BDBM352900

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)c1C

BDBM337911

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2nccn2C)c1

BDBM337991

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(C)(=O)=O)c1

BDBM338210

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(Nc2nc3ccccc3o2)c1

BDBM338306

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(OCC2CC2)c1

BDBM338293

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(OS(=O)(=O)c2ccc(F)cc2F)c1

BDBM338247

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)C(=O)Nc1ccc(F)cc1F

BDBM337902

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)N(CC1CC1)S(=O)(=O)C1CC1

BDBM338141

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)N(CCO)S(=O)(=O)c1ccc(F)cc1F

BDBM338177

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)N1CC(CS1(=O)=O)NCc1ccccc1

BDBM338232

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)N1CC=CS1(=O)=O |c:21|

BDBM338275

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)N1CCCNC1=O

BDBM338205

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)N1CCCNS1(=O)=O

BDBM337907

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)N1CCCS1(=O)=O

BDBM338172

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)N1CCNS1(=O)=O

BDBM338234

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)S(=O)(=O)NC12CC(C1)C2

BDBM338173

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)S(=O)(=O)Nc1ccc(F)cc1F

BDBM338212

CC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)S(N)(=O)=O

BDBM346222

CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(CC3CC3)ccc12

BDBM346193

CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(cc(C)c12)S(C)(=O)=O

BDBM346202

CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(cc(F)c12)S(=O)(=O)C1CC1

BDBM346232

CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(cc(F)c12)S(C)(=O)=O

BDBM346230

CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)C1CC1

BDBM346210

CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)N1CCCC1

BDBM346199

CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)c1ccc(F)cc1F

BDBM346192

CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)c1ccccc1

BDBM346220

CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)c1ccccc1C

BDBM346231

CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(C)(=O)=O

BDBM346227

CC(=O)Nc1cc(ccn1)-c1cnc(CN)c2n(ccc12)S(=O)(=O)C1CC1

BDBM338288

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(N2CCCNS2(=O)=O)c1C

BDBM338241

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(N2CCCS2(=O)=O)c1C

BDBM338292

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)N2CC3CCC2C3)c1C

BDBM338303

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)N2CCCC2)c1C

BDBM338174

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2c(Cl)cccc2Cl)c1C

BDBM338217

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1C

BDBM338052

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2cc(F)ccc2F)c1C

BDBM338260

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(Br)cc2F)c1C

BDBM338068

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1C

BDBM338216

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(Cl)cc2F)c1C

BDBM338114

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1C

BDBM337977

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2F)c1C

BDBM338245

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C#N)c1C

BDBM338181

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2Cl)C#N)c1C

BDBM338153

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2Cl)C(F)(F)F)c1C

BDBM338155

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2F)C2CC2)c1C

BDBM352759

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(Cl)c2Cl)c1

BDBM338253

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc3ncccc23)c1C

BDBM338136

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1C

BDBM338065

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2Cl)c1C

BDBM338076

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2F)c1C

BDBM338307

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)c1C

BDBM338264

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(c1)N1CCCNS1(=O)=O

BDBM338185

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(c1)S(=O)(=O)NC12CC(C1)C2

BDBM338254

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(c1)S(=O)(=O)NC1CCC1

BDBM352814

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(c1)S(=O)(=O)N[C@@H](CO)c1ccccc1 |r|

BDBM338150

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(c1)S(=O)(=O)N[C@H](CO)c1ccccc1 |r|

BDBM338226

CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(c1C)S(=O)(=O)NC(C)(C)C

BDBM337988

CC(=O)Nc1cc(ccn1)-c1cnc(F)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM337852

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(NCC2CC2)c1

BDBM337881

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM337877

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)N1CCC(F)(F)C1

BDBM338024

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)N1CCC1

BDBM337832

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)N1CCCC1

BDBM337827

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)N1CCCCC1

BDBM337976

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)N1CCOCC1

BDBM337981

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)N1CC[C@@H](F)C1 |r|

BDBM337888

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)N1CCc2ccccc12

BDBM337949

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)N1Cc2ccccc2C1

BDBM338225

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)NC(N)=N

BDBM338011

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)NC12CC(C1)C2

BDBM337993

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)NC1CC1

BDBM338035

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)NC1CCOCC1

BDBM337831

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)NCC1CC1

BDBM337945

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)Nc1cc(C)cnn1

BDBM337901

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)Nc1cccc(F)c1

BDBM338003

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)Nc1cccc(F)c1F

BDBM337960

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)Nc1ccccc1Cl

BDBM337910

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)Nc1cccnc1

BDBM338157

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)N1CCCC1=O

BDBM338304

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)N1CCCNS1(=O)=O

BDBM338005

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)N1CCCS1(=O)=O

BDBM338033

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)CC1CC1

BDBM337950

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)CCc1ccccc1

BDBM337918

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Cc1ccc(Cl)cc1

BDBM337962

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Cc1ccc(F)cc1F

BDBM337820

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Cc1ccc2ccccc2c1

BDBM337823

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Cc1ccccc1

BDBM337867

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Cc1ccccc1C(F)(F)F

BDBM337996

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Cc1ccccc1Cl

BDBM338021

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Cc1ccccc1F

BDBM338029

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Cc1cccnc1

BDBM337906

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)N1CCCC1

BDBM337980

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)N1CCCCC1

BDBM337841

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)N1CCOCC1

BDBM337828

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)NC12CC(C1)C2

BDBM337920

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)NC1CCCCC1

BDBM337927

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)NCC1CC1

BDBM338007

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)NCC1CCCCC1

BDBM337972

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)NCCc1ccccc1

BDBM337836

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)NCc1cccnc1

BDBM338032

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Nc1ccc(Cl)cc1

BDBM337994

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Nc1ccc(F)cc1F

BDBM337917

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Nc1ccc2ccccc2c1

BDBM337916

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Nc1cccc(Cl)c1

BDBM337860

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Nc1ccccc1

BDBM338028

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Nc1cccnc1

BDBM337914

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(C)(=O)=O

BDBM337878

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(N)(=O)=O

BDBM337946

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(O)(=O)=O

BDBM337866

CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1C)S(=O)(=O)NCC1CC1

BDBM337870

CC(=O)Nc1cc(ccn1)-c1cnc(NCC2CC2)c(N)c1

BDBM337882

CC(=O)Nc1cc(ccn1)-c1cnc(NCC2CC2)c(NCC2CC2)c1

BDBM337885

CC(=O)Nc1cc(ccn1)-c1cnc2N(CC3CC3)S(=O)(=O)Nc2c1

BDBM337884

CC(=O)Nc1cc(ccn1)-c1cnc2NCCc2c1

BDBM337846

CC(=O)Nc1cc(ccn1)-c1cnc2NS(=O)(=O)N(CC3CC3)c2c1

BDBM338195

CC(=O)Nc1cc(ccn1)-c1cnc2OCCN(C34CC(C3)C4)S(=O)(=O)c2c1

BDBM338299

CC(=O)Nc1cc(ccn1)-c1cnc2OCCNS(=O)(=O)c2c1

BDBM338154

CC(=O)Nc1cc(ccn1)-c1cnc2OC[C@@H](NS(=O)(=O)c2c1)c1ccccc1 |r|

BDBM338236

CC(=O)Nc1cc(ccn1)-c1cnc2OC[C@H](NS(=O)(=O)c2c1)c1ccccc1 |r|

BDBM337883

CC(=O)Nc1cc(ccn1)-c1cnc2[nH]c(C)nc2c1

BDBM352475

CC(=O)Nc1cc(ccn1)-c1cnc2[nH]cc(CN3CCCC3)c2c1

BDBM337982

CC(=O)Nc1cc(ccn1)-c1cnc2[nH]cc(c2c1)S(=O)(=O)N1CCCC1

BDBM338000

CC(=O)Nc1cc(ccn1)-c1cnc2[nH]cc(c2c1)S(=O)(=O)c1ccccc1

BDBM337964

CC(=O)Nc1cc(ccn1)-c1cnc2[nH]ccc2c1

BDBM338013

CC(=O)Nc1cc(ccn1)-c1cnc2[nH]ncc2c1

BDBM337834

CC(=O)Nc1cc(ccn1)-c1cnc2cc[nH]c2c1

BDBM337912

CC(=O)Nc1cc(ccn1)-c1cnc2ccn(CC3CC3)c2c1

BDBM338023

CC(=O)Nc1cc(ccn1)-c1cnc2ccn(c2c1)S(=O)(=O)C1CC1

BDBM337840

CC(=O)Nc1cc(ccn1)-c1cnc2ccn(c2c1)S(=O)(=O)c1ccccc1

BDBM337850

CC(=O)Nc1cc(ccn1)-c1cnc2ccn(c2c1)S(C)(=O)=O

BDBM337924

CC(=O)Nc1cc(ccn1)-c1cnc2cn(nc2c1)S(=O)(=O)C1CC1

BDBM337935

CC(=O)Nc1cc(ccn1)-c1cnc2cn[nH]c2c1

BDBM337819

CC(=O)Nc1cc(ccn1)-c1cnc2cnn(c2c1)S(=O)(=O)C1CC1

BDBM337975

CC(=O)Nc1cc(ccn1)-c1cnc2n(C)cc(c2c1)S(=O)(=O)N1CCCC1

BDBM337871

CC(=O)Nc1cc(ccn1)-c1cnc2n(N)cc(CN3CCCC3)c2c1

BDBM337959

CC(=O)Nc1cc(ccn1)-c1cnc2ncn(CC3CC3)c2c1

BDBM338008

CC(=O)Nc1cc(ccn1)-c1cncc(C=O)c1

BDBM337963

CC(=O)Nc1cc(ccn1)-c1cncc(N)c1

BDBM337925

CC(=O)Nc1cc(ccn1)-c1cncc(NC(=O)Cc2ccccc2)c1

BDBM338235

CC(=O)Nc1cc(ccn1)-c1cncc(NC(=O)c2ccc(F)cc2F)c1

BDBM337830

CC(=O)Nc1cc(ccn1)-c1cncc(NC(=O)c2ccccc2)c1

BDBM337829

CC(=O)Nc1cc(ccn1)-c1cncc(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM337921

CC(=O)Nc1cc(ccn1)-c1cncc(NS(=O)(=O)c2ccc(F)cc2F)c1C

BDBM338211

CC(=O)Nc1cc(ccn1)-c1cncc(NS(=O)(=O)c2ccc(F)cc2F)c1Cl

BDBM338287

CC(=O)Nc1cc(ccn1)-c1cncc(Nc2ncco2)c1

BDBM338012

CC(=O)Nc1cc(ccn1)-c1cncc(\C=C\C(=O)c2ccc(F)cc2)c1

BDBM337825

CC(=O)Nc1cc(ccn1)-c1cncc(c1)C(=O)C1CC1

BDBM338022

CC(=O)Nc1cc(ccn1)-c1cncc(c1)C(=O)\C=C\c1ccc(F)cc1

BDBM338018

CC(=O)Nc1cc(ccn1)-c1cncc(c1)C(C)=O

BDBM338026

CC(=O)Nc1cc(ccn1)-c1cncc(c1)N(CC1CC1)S(C)(=O)=O

BDBM338203

CC(=O)Nc1cc(ccn1)-c1cncc(c1)N(CCO)S(=O)(=O)c1ccc(F)cc1F

BDBM338142

CC(=O)Nc1cc(ccn1)-c1cncc(c1)N1CCCCS1(=O)=O

BDBM338016

CC(=O)Nc1cc(ccn1)-c1cncc(c1)N1CCCS1(=O)=O

BDBM338221

CC(=O)Nc1cc(ccn1)-c1cncc(c1)N1CCOc2cc(F)ccc2S1(=O)=O

BDBM338209

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)N1CC(F)(F)C1

BDBM337942

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)N1CCC(F)(F)C1

BDBM337826

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)N1CCC(F)(F)CC1

BDBM338289

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)N1CCC1

BDBM337864

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)N1CCCC1

BDBM338259

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C

BDBM338014

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)NC12CC(C1)C2

BDBM338283

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:19:20:23:26.27.25,27:26:29:23.22.21,27:22:29:26.28.25,THB:28:26:23:29.20.21,28:20:23:26.27.25|

BDBM338140

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)NC1C2CC3CC(C2)CC1C3 |TLB:19:20:27:23.24.29,22:23:27:20.21.26,THB:22:21:27:23.24.29,24:23:20:27.25.26,24:25:20:23.22.29,(-6.67,-4.52,;-5.33,-3.75,;-5.33,-2.21,;-4,-4.52,;-2.66,-3.75,;-2.66,-2.21,;-1.33,-1.44,;0,-2.21,;0,-3.75,;-1.33,-4.52,;-1.33,.1,;-2.66,.87,;-2.66,2.41,;-1.33,3.18,;0,2.41,;0,.87,;1.34,3.18,;.57,4.52,;2.11,1.85,;2.67,3.95,;4,3.18,;5.34,3.95,;6.67,3.18,;6.67,1.64,;5.77,-.28,;4.57,.39,;4.58,2.79,;3.17,-.26,;4,1.64,;5.34,.87,)|

BDBM338158

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)NC1CC1

BDBM338213

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)NC1CCC1

BDBM338143

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)NCc1ccccc1

BDBM338279

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)Nc1ccc(F)cc1F

BDBM338274

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)Nc1ccccc1

BDBM337868

CC(=O)Nc1cc(ccn1)-c1cncc(c1)S(C)(=O)=O

BDBM338276

CC(=O)Nc1cc(ccn1)-c1cncc(c1C)S(=O)(=O)NC(C)(C)C

BDBM346207

CC(=O)Nc1cc(ccn1)-c1cncc2[nH]ccc12

BDBM346217

CC(=O)Nc1cc(ccn1)-c1cncc2n(c(C)cc12)S(=O)(=O)c1ccccc1

BDBM346223

CC(=O)Nc1cc(ccn1)-c1cncc2n(ccc12)S(=O)(=O)C1CC1

BDBM346225

CC(=O)Nc1cc(ccn1)-c1cncc2n(ccc12)S(=O)(=O)c1ccccc1

BDBM346208

CC(=O)Nc1cc(ccn1)-c1cncc2n(ccc12)S(C)(=O)=O

BDBM346209

CC(=O)Nc1cc(ccn1)-c1cncc2n(ncc12)S(=O)(=O)C1CC1

BDBM338266

CC(=O)Nc1cc(cn2nccc12)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338190

CC(=O)Nc1cc(cn2nccc12)-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM346226

CC(=O)Nc1cccc(c1)-c1cnc(C)c2[nH]ccc12

BDBM50439711

CC(=O)Nc1cn2cc(ccc2n1)-c1cnc(N)c(c1)C(F)(F)F

BDBM50160066

CC(=O)Nc1nc(C)c(s1)-c1ccc(Br)c(c1)S(=O)(=O)NCCO

BDBM50160072

CC(=O)Nc1nc(C)c(s1)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1ccc(F)cc1

BDBM50160071

CC(=O)Nc1nc(C)c(s1)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1ccc(O)cc1

BDBM50343200

CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1

BDBM50042924

CC(=O)\N=c1\[nH]c(C)c(s1)-c1ccc(Cl)c(c1)S(=O)(=O)NCCO

BDBM50390410

CC(=O)c1ccc(cc1)-c1sc(NC(=O)NCCC(=O)NC(C)(C)C)nc1C

BDBM50156297

CC(C)(C)CNc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccncc2)n1

BDBM50401152

CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1

BDBM50156298

CC(C)(C)Nc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccncc2)n1

BDBM50612811

CC(C)(C)c1cc(Nc2cc(Cl)nc(Oc3ccc(cc3)[N+]([O-])=O)n2)n[nH]1

BDBM50112827

CC(C)(C)c1nc-2c(CCc3nc(NC(=O)N4CCC[C@H]4C(N)=O)sc-23)s1 |r|

BDBM50112820

CC(C)(C)c1ncc2CCc3nc(NC(=O)N4CCC[C@@]4(C)C(N)=O)sc3-c2n1 |r|

BDBM50197067

CC(C)(O)CNc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccnc(Cl)c2)n1

BDBM50156296

CC(C)(O)CNc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccncc2)n1

BDBM50426176

CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1 |(2.18,-16.72,;2.94,-15.38,;2.16,-14.06,;4.48,-15.37,;5.24,-14.03,;4.46,-12.71,;6.78,-14.02,;7.54,-12.68,;9.08,-12.67,;9.86,-14,;9.84,-11.33,;11.38,-11.32,;12.14,-9.98,;11.37,-8.66,;12.13,-7.32,;13.67,-7.31,;14.58,-8.56,;16.04,-8.08,;17.38,-8.84,;18.71,-8.06,;18.69,-6.52,;17.36,-5.76,;17.35,-4.23,;18.68,-3.45,;18.67,-1.92,;17.33,-1.15,;16,-1.93,;16.01,-3.47,;16.04,-6.54,;14.57,-6.07,;20.04,-8.82,;20.05,-10.36,;21.39,-11.12,;22.72,-10.34,;22.7,-8.79,;23.82,-7.76,;23.19,-6.37,;21.67,-6.54,;21.36,-8.04,;9.83,-8.66,;9.07,-10,)|

BDBM50503132

CC(C)C(=O)CN1[C@@H](CCn2c1nc(cc2=O)N1CCOC[C@H]1C)C(F)(F)F |r|

BDBM548282

CC(C)C1(CO)CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM337891

CC(C)CNS(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM352495

CC(C)CNS(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(N)=O)c1

BDBM548293

CC(C)C[C@@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM548294

CC(C)C[C@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM337896

CC(C)N(C(C)C)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM295147

CC(C)N1CCC(CC1)NS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1nc(C)no1

BDBM337824

CC(C)NS(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM50503136

CC(C)OCCN1[C@@H](CCn2c1nc(cc2=O)N1CCOCC1)C(F)(F)F |r|

BDBM295160

CC(C)ONS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1nc(C)no1

BDBM338262

CC(C)Oc1cc(cnc1C)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM337999

CC(C)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM50597814

CC(C)[C@@H]1CNC(=O)c2cc(nn12)-c1cc(NC(=O)C2CC2)ncc1C |r|

BDBM50597813

CC(C)[C@@H]1CNC(=O)c2cc(nn12)-c1ccnc(NC(=O)C2CC2)c1 |r|

BDBM50597815

CC(C)[C@@H]1CNC(=O)c2cc(nn12)N1CCOCC1 |r|

BDBM548235

CC(C)[C@@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM548268

CC(C)[C@@H]1n2nc(cc2C(=O)NC11CC1)N1CCOC[C@H]1C |r|

BDBM548260

CC(C)[C@@]1(C)CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM50449975

CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(C)cc2)c1 |r|

BDBM50449964

CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(C)c2)c1 |r|

BDBM50449972

CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2C)c1 |r|

BDBM548236

CC(C)[C@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM548267

CC(C)[C@H]1n2nc(cc2C(=O)NC11CC1)N1CCOC[C@H]1C |r|

BDBM548259

CC(C)[C@]1(C)CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM295110

CC(C)c1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM295108

CC(C)c1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM337958

CC(C)c1ccc(cc1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM295043

CC(C)c1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM315477

CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12

BDBM50434806

CC(C)n1nc(C)nc1-c1cn2CCOc3cc(ccc3-c2n1)-c1cnn(c1)C(C)(C)C(N)=O

BDBM602729

CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1

BDBM295243

CC(O)CNS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cnc(C)o1

BDBM295248

CC(O)CNS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1nc(C)no1

BDBM338170

CC(OCc1ccccn1)c1cncc(c1)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338156

CC(Oc1ccccc1Cl)c1cncc(c1)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338238

CC(Oc1ccccc1F)c1cncc(c1)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338199

CC1CCCCN1c1cc(cnc1C#N)-c1ccnc(NC(C)=O)c1

BDBM337900

CC1CCN(CC1)C(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM510499

CC1COCCN1c1cc(-c2ccccc2Cl)n(C)c(=O)c1

BDBM600779

CC1COCCN1c1cc(Cl)n(C)c(c1)-c1ccccc1Cl

BDBM510502

CC1COCCN1c1cc([nH]c(=O)c1)-c1ccccc1-c1ccccc1

BDBM510498

CC1COCCN1c1cc([nH]c(=O)c1)-c1ccccc1Cl

BDBM510500

CC1COCCN1c1cc([nH]c(=O)c1)-c1cnccc1C

BDBM510501

CC1COCCN1c1cc([nH]c(=O)c1)-c1cncnc1

BDBM527935

CC1COCCN1c1cc([nH]c(=O)c1)C1=CCOCC1 |t:16|

BDBM527936

CC1COCCN1c1cc([nH]c(=O)c1)C1CCOCC1

BDBM527939

CC1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1ccccc1

BDBM527938

CC1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1cccnc1

BDBM50597818

CC1COc2cc(ccc2-c2nc(sc12)-c1ncnn1-c1ccc(F)cc1F)C(N)=O

BDBM50328584

CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1

BDBM118299

CCC(=O)N1CC[C@@H](C1)Nc1ncnc2CCN(Cc12)c1cnc(OC)c(c1)C(F)(F)F |r|

BDBM50469458

CCC(CC)n1cnc2c(nc(nc12)N1CC2CCC(C1)O2)-c1cnc(N)cn1

BDBM338171

CCCCN(CCCC)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM338192

CCCCS(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM295159

CCCONS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1nc(C)no1

BDBM295105

CCCc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM338097

CCN(C)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM338126

CCN(CC)C(=O)c1cc(cnc1C)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM337844

CCN(CC)C(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM338189

CCN(CC)S(=O)(=O)c1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM337948

CCN(CC)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM337944

CCN(CC)S(=O)(=O)c1cncc(c1)-c1ccnc(NC(C)=O)c1

BDBM337843

CCN(c1cc(cnc1C)-c1ccnc(NC(C)=O)c1)S(=O)(=O)C1CC1

BDBM295140

CCN1CCCC1CNS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1

BDBM50355393

CCN1CCN(CC1)c1ccc(Nc2cc(ncn2)N(C)C(=O)Nc2c(Cl)c(OC)cc(OC)c2Cl)cc1

BDBM50610495

CCN1CCN(CC1)c1ccc(Nc2ncnc(n2)N(C)C(=O)Nc2c(Cl)c(OC)c(Cl)c(OC)c2Cl)cc1

BDBM338186

CCNC(=O)Nc1cc(cnc1C)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338183

CCOC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)N(C)C)c1

BDBM338271

CCOC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(Cl)cc2F)c1

BDBM338207

CCOC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM346228

CCOC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)C1CC1

BDBM346233

CCOC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)c1ccccc1

BDBM338202

CCOC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2F)c1C

BDBM346212

CCOC(=O)Nc1cc(ccn1)-c1cncc2n(ccc12)S(C)(=O)=O

BDBM337969

CCOCCS(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM295090

CCONS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1

BDBM338294

CCOc1cc(cnc1C)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM532962

CCS(=O)(=O)N1CCN(C(C1)C(F)(F)F)c1cc(cc(=O)[nH]1)-c1ccnc(NC(C)=O)c1

BDBM532271

CCS(=O)(=O)N1CCN(C(C1)C(F)(F)F)c1cc(cc(=O)[nH]1)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM580179

CCS(=O)(=O)N1CCN(C(C1)C(F)(F)F)c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(C)cc12

BDBM580182

CCS(=O)(=O)N1CCN(C(C1)C(F)(F)F)c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(cc12)C#N

BDBM580176

CCS(=O)(=O)N1CCN(C(C1)C(F)(F)F)c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(cc12)C1CC1

BDBM580177

CCS(=O)(=O)N1CCN(C(C1)C(F)(F)F)c1cc(cc(=O)[nH]1)-c1ccnc2[nH]ccc12

BDBM337886

CCS(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM346204

CCS(=O)(=O)n1ccc2c(cnc(C)c12)-c1ccnc(NC(C)=O)c1

BDBM548295

CC[C@@H](C)C[C@@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM548296

CC[C@@H](C)C[C@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM548278

CC[C@@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM548262

CC[C@@]1(CNC(=O)c2cc(nn12)N1CCOC[C@H]1C)C1CC1 |r|

BDBM548297

CC[C@H](C)C[C@@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM50403068

CC[C@H](Nc1ncnc2nc[nH]c12)c1nc2cccc(F)c2c(=O)n1-c1ccccc1 |r|

BDBM548279

CC[C@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM548261

CC[C@]1(CNC(=O)c2cc(nn12)N1CCOC[C@H]1C)C1CC1 |r|

BDBM352681

CCc1c(NS(=O)(=O)c2ccc(F)cc2F)c(C)ncc1-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338102

CCc1c(NS(=O)(=O)c2ccc(F)cc2F)c(Cl)ncc1-c1ccnc(NC(=O)C2CC2)c1

BDBM338284

CCc1c(NS(=O)(=O)c2ccc(F)cc2F)c(Cl)ncc1-c1ccnc(NC(C)=O)c1

BDBM338084

CCc1c(NS(=O)(=O)c2ccc(F)cc2F)c(Cl)ncc1-c1ccnc(Nc2ccnc(C)n2)c1

BDBM295038

CCc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM346211

CCc1cc2c(cncc2n1S(=O)(=O)c1ccccc1)-c1ccnc(NC(C)=O)c1

BDBM337861

CCc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM346191

CCc1ncc(-c2ccnc(NC(C)=O)c2)c2ccn(c12)S(C)(=O)=O

BDBM338025

CCc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM295045

CCc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM532974

CCn1cc(c(n1)C(F)(F)F)-c1cc(cc(=O)[nH]1)-c1ccnc(NC(=O)OC)c1

BDBM532969

CCn1cc(c(n1)C(F)(F)F)-c1cc(cc(=O)[nH]1)-c1ccnc(NC(C)=O)c1

BDBM532279

CCn1cc(c(n1)C(F)(F)F)-c1cc(cc(=O)[nH]1)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM527971

CCn1ccc(n1)C1CCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM527972

CCn1ccc(n1)[C@@H]1CCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM527973

CCn1ccc(n1)[C@H]1CCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM50390411

CCn1nnc(CCNC(=O)Nc2nc(C)c(s2)-c2ccc(c(F)c2)S(C)(=O)=O)n1

BDBM338206

CN(C(=O)c1cc(cnc1C)-c1ccnc(NC(=O)C2CC2)c1)C12CC(C1)C2

BDBM338300

CN(C(=O)c1cc(cnc1C)-c1ccnc(NC(C)=O)c1)c1ccc(F)cc1F

BDBM338099

CN(C(=O)c1cc(cnc1C)-c1ccnc(Nc2ccnc(C)n2)c1)C12CC(C1)C2

BDBM338167

CN(C(=O)c1cc(cnc1C)-c1ccnc(Nc2ccnc(C)n2)c1)c1ccc(F)cc1F

BDBM338101

CN(C(=O)c1cc(cnc1N)-c1ccnc(Nc2ccnc(C)n2)c1)C12CC(C1)C2

BDBM338122

CN(C(=O)c1cc(cnc1N)-c1ccnc(Nc2ccncn2)c1)C12CC(C1)C2

BDBM338215

CN(C(=O)c1ccc(F)cc1F)c1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM338214

CN(C(=O)c1ccc(F)cc1F)c1cncc(c1)-c1ccnc(NC(C)=O)c1

BDBM338059

CN(C(=O)c1cncc(c1)-c1ccnc(Nc2ccnc(C)n2)c1)C12CC(C1)C2

BDBM532975

CN(C)C(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1ccccc1C(F)(F)F

BDBM337894

CN(C)C(=O)c1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM338090

CN(C)C(=O)c1cc(cnc1C)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338038

CN(C)C(=O)c1cc(cnc1Cl)-c1ccnc(NC(C)=O)c1

BDBM337986

CN(C)C(=O)c1cc(cnc1N(C)C)-c1ccnc(NC(C)=O)c1

BDBM337973

CN(C)C(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM295158

CN(C)C(=O)c1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM337865

CN(C)C(=O)c1cncc(c1)-c1ccnc(NC(C)=O)c1

BDBM50308135

CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1

BDBM295083

CN(C)C1CN(C1)S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1

BDBM338311

CN(C)C1CN(c2cc(cnc2C)-c2ccnc(NC(C)=O)c2)S(=O)(=O)C1

BDBM338198

CN(C)CCOc1cc(cnc1C)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM50112818

CN(C)C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc2CCc3sc(nc3-c2s1)C(C)(C)C |r|

BDBM50112825

CN(C)C[C@]1(CCCN1C(=O)Nc1nc2CCc3cnc(nc3-c2s1)C(C)(C)C)C(N)=O |r|

BDBM337904

CN(C)Cc1c[nH]c2ncc(cc12)-c1ccnc(NC(C)=O)c1

BDBM295181

CN(C)Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM338273

CN(C)S(=O)(=O)N(C)c1cncc(c1)-c1ccnc(NC(C)=O)c1

BDBM338085

CN(C)S(=O)(=O)Nc1c(C)ncc(c1C)-c1ccnc(NC(C)=O)c1

BDBM338061

CN(C)S(=O)(=O)Nc1c(Cl)ncc(c1C)-c1ccnc(NC(C)=O)c1

BDBM338200

CN(C)S(=O)(=O)Nc1c(Cl)ncc(c1C)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338251

CN(C)S(=O)(=O)Nc1c(Cl)ncc(c1C)-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM50401261

CN(C)S(=O)(=O)Nc1cc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cnc1Cl

BDBM338291

CN(C)S(=O)(=O)Nc1cc(cn2nccc12)-c1ccnc(NC(C)=O)c1

BDBM338237

CN(C)S(=O)(=O)Nc1cc(cn2nccc12)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338243

CN(C)S(=O)(=O)Nc1cc(cn2nccc12)-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM338105

CN(C)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(N)c1

BDBM338069

CN(C)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(=O)C2CC2(F)F)c1

BDBM338135

CN(C)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(=O)C2CC2)c1

BDBM337849

CN(C)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM338054

CN(C)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(Nc2ccc(C#N)c(C)n2)c1

BDBM338110

CN(C)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338042

CN(C)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(Nc2ccncn2)c1

BDBM338087

CN(C)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(c1)-n1cnc2c(C)nccc12

BDBM338191

CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccnc(NC(C)=O)c1

BDBM338169

CN(C)S(=O)(=O)Nc1cncc(c1)-c1ccnc(NC(C)=O)c1

BDBM338244

CN(C)S(=O)(=O)Oc1cc(cn2nccc12)-c1ccnc(NC(C)=O)c1

BDBM338179

CN(C)S(=O)(=O)Oc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM337857

CN(C)S(=O)(=O)c1c[nH]c2ncc(cc12)-c1ccnc(NC(C)=O)c1

BDBM338010

CN(C)S(=O)(=O)c1cc(cnc1N)-c1cc(NC(C)=O)ncc1F

BDBM337943

CN(C)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM337990

CN(C)S(=O)(=O)c1cc(cnc1N)-c1ccnc(Nc2ncco2)c1

BDBM337961

CN(C)S(=O)(=O)c1cncc(c1)-c1ccnc(NC(C)=O)c1

BDBM346195

CN(C)S(=O)(=O)n1ccc2c(cnc(C)c12)-c1ccnc(NC(C)=O)c1

BDBM346219

CN(C)S(=O)(=O)n1ccc2c(cncc12)-c1ccnc(NC(C)=O)c1

BDBM295086

CN(C)[C@H]1CCN(C1)S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1 |r|

BDBM338138

CN(C)c1c(C)c(cnc1Cl)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM50612810

CN(C)c1cc(Nc2cc(C)[nH]n2)nc(Oc2ccc(cc2)[N+]([O-])=O)n1

BDBM346206

CN(C)c1ncc(-c2ccnc(NC(C)=O)c2)c2ccn(c12)S(=O)(=O)C1CC1

BDBM338302

CN(C)c1ncc(c(C)c1S(=O)(=O)NC(C)(C)C)-c1ccnc(NC(C)=O)c1

BDBM338130

CN(C)c1ncc(cc1C(=O)N(C)C12CC(C1)C2)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338108

CN(C)c1ncc(cc1C(=O)N(C)C12CC(C1)C2)-c1ccnc(Nc2ccncn2)c1

BDBM337998

CN(C)c1ncc(cc1C(=O)N(C)c1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM338107

CN(C)c1ncc(cc1C(=O)NC12CC(C1)C2)-c1ccnc(NC(C)=O)c1

BDBM337931

CN(C)c1ncc(cc1C(=O)Nc1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM337842

CN(C)c1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM338305

CN(C)c1ncc(cc1S(=O)(=O)Nc1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM337929

CN(CC1CC1)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM337895

CN(Cc1ccccc1)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM337953

CN(c1cc(c[n+]([O-])c1C)-c1ccnc(NC(C)=O)c1)S(C)(=O)=O

BDBM338037

CN(c1cc(cnc1C)-c1ccnc(NC(C)=O)c1)S(=O)(=O)C1CC1

BDBM337863

CN(c1cc(cnc1C)-c1ccnc(NC(C)=O)c1)S(=O)(=O)c1ccccc1

BDBM337915

CN(c1cc(cnc1C)-c1ccnc(NC(C)=O)c1)S(C)(=O)=O

BDBM337957

CN(c1cc(cnc1N)-c1ccnc(NC(C)=O)c1)S(C)(=O)=O

BDBM338308

CN(c1ccccc1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM337854

CN(c1ccccc1)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM338184

CN(c1ccccc1)S(=O)(=O)c1cncc(c1)-c1ccnc(NC(C)=O)c1

BDBM337837

CN(c1cncc(c1)-c1ccnc(NC(C)=O)c1)S(C)(=O)=O

BDBM50346961

CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1

BDBM338165

CN1CCCN(c2cc(cnc2C)-c2ccnc(NC(C)=O)c2)S1(=O)=O

BDBM338112

CN1CCCN(c2cc(cnc2C)-c2ccnc(Nc3ccnc(C)n3)c2)S1(=O)=O

BDBM338282

CN1CCCN(c2cc(cnc2Cl)-c2ccnc(NC(C)=O)c2)S1(=O)=O

BDBM338145

CN1CCCN(c2cc(cnc2N)-c2ccnc(NC(C)=O)c2)S1(=O)=O

BDBM338267

CN1CCCN(c2cncc(c2)-c2ccnc(NC(C)=O)c2)S1(=O)=O

BDBM50607956

CN1CCN(C)\C(C1)=N\c1ccc(cc1C(=O)Nc1ccccc1)[N+]([O-])=O

BDBM337898

CN1CCN(CC1)C(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM338094

CN1CCN(CC1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM337922

CN1CCN(CC1)S(=O)(=O)c1c[nH]c2ncc(cc12)-c1ccnc(NC(C)=O)c1

BDBM337822

CN1CCN(CC1)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM352426

CN1CCN(CC1)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(N)=O)c1

BDBM338296

CN1CCN(CC1)S(=O)(=O)c1cncc(c1)-c1ccnc(NC(C)=O)c1

BDBM153718

CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Oc2ccc(cc2)[N+]([O-])=O)n1

BDBM338204

CN1CCN(c2cc(cnc2C)-c2ccnc(NC(C)=O)c2)S1(=O)=O

BDBM337838

CN1CNc2ncc(cc2S1(=O)=O)-c1ccnc(NC(C)=O)c1

BDBM337874

CNC(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM50550963

CNC(=O)c1ccc(cc1)-c1cnc2cnc(cn12)C(=O)N(C)c1ccc(Cl)cc1

BDBM50429701

CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|

BDBM50550964

CNC(=O)c1cncc(c1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1

BDBM338147

CNC1CN(c2cc(cnc2C)-c2ccnc(NC(C)=O)c2)S(=O)(=O)C1

BDBM338270

CNS(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM337908

CNS(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1

BDBM338081

CNc1c(C)c(cnc1Cl)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338252

CNc1ncc(c(C)c1S(=O)(=O)NC(C)(C)C)-c1ccnc(NC(C)=O)c1

BDBM50156334

CNc1ncc(c(CC2CC2)n1)-c1ccnc(NC2CCCCC2)n1

BDBM50156333

CNc1ncc(c(CC2CC2)n1)-c1ccnc(NC2CCOCC2)n1

BDBM50156335

CNc1ncc(c(CC2CC2)n1)-c1ccnc(NCCCO)n1

BDBM50156332

CNc1ncc(c(CC2CC2)n1)-c1ccnc(N[C@H]2CC[C@H](N)CC2)n1 |r,wU:21.23,wD:18.19,(-1.08,8.31,;-.01,7.7,;-0,6.16,;-1.34,5.39,;-1.33,3.85,;,3.08,;1.33,3.85,;2.67,3.09,;4,3.86,;5.46,3.82,;4.68,5.15,;1.33,5.39,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;1.33,-.77,;2.67,-1.54,;2.66,-3.08,;1.33,-3.85,;1.32,-5.39,;2.65,-6.16,;2.65,-7.4,;3.99,-5.4,;4,-3.86,;1.33,.77,)|

BDBM50156293

CNc1ncc(c(CC2CC2)n1)-c1ccnc(N[C@H]2CC[C@H](O)CC2)n1 |r,wU:21.23,wD:18.19,(-9.3,9.74,;-9.31,8.51,;-7.98,7.73,;-6.64,8.49,;-5.31,7.71,;-5.32,6.17,;-6.66,5.41,;-6.67,3.87,;-8.01,3.11,;-8.71,1.83,;-9.47,3.17,;-7.99,6.19,;-3.99,5.4,;-2.65,6.16,;-1.32,5.39,;-1.33,3.85,;-2.66,3.08,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;1.33,-.77,;2.4,-1.39,;1.33,.77,;,1.54,;-4,3.86,)|

BDBM50156337

CNc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccc(OC)cc2)n1

BDBM50156336

CNc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccccc2)n1

BDBM50156302

CNc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccncc2)n1

BDBM50156338

CNc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2cnc3ccccc3c2)n1

BDBM337839

CNc1ncc(cc1C(=O)N(C)C)-c1ccnc(NC(C)=O)c1

BDBM338265

CNc1ncc(cc1C(=O)N(C)C12CC(C1)C2)-c1ccnc(NC(C)=O)c1

BDBM338047

CNc1ncc(cc1C(=O)N(C)C12CC(C1)C2)-c1ccnc(Nc2ccncn2)c1

BDBM337984

CNc1ncc(cc1C(=O)NC12CC(C1)C2)-c1ccnc(NC(C)=O)c1

BDBM337971

CNc1ncc(cc1N(C)S(C)(=O)=O)-c1ccnc(NC(C)=O)c1

BDBM337965

CNc1ncc(cc1N(CC1CC1)S(C)(=O)=O)-c1ccnc(NC(C)=O)c1

BDBM337956

CNc1ncc(cc1N1CCCS1(=O)=O)-c1ccnc(NC(C)=O)c1

BDBM337848

CNc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM337997

CNc1ncc(cc1S(=O)(=O)N(C(C)C)C(C)C)-c1ccnc(NC(C)=O)c1

BDBM337880

CNc1ncc(cc1S(=O)(=O)Nc1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM337919

CNc1ncc(cc1S(=O)(=O)Nc1ccccc1)-c1ccnc(NC(C)=O)c1

BDBM532971

COC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1ccccc1C(F)(F)F

BDBM532972

COC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1ccccc1Cl

BDBM532973

COC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1cccnc1C(F)(F)F

BDBM532979

COC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)N1CCCCC1C(F)(F)F

BDBM532970

COC(=O)Nc1cc(ccn1)-c1cc([nH]c(=O)c1)N1CCOCC1C(F)(F)F

BDBM338066

COC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)N(C)C)c1

BDBM338233

COC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(Cl)cc2F)c1

BDBM338019

COC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM337970

COC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)N1CCCS1(=O)=O

BDBM352593

COC(=O)Nc1cc(ccn1)-c1cnc(C)c(c1)S(=O)(=O)N(C)C

BDBM346229

COC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)C1CC1

BDBM346200

COC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)C1CCCC1

BDBM346203

COC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)CC(C)C

BDBM346194

COC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)N(C)C

BDBM346190

COC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)c1ccccc1

BDBM346224

COC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(C)(=O)=O

BDBM338080

COC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2F)c1C

BDBM337872

COC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)N(C)C

BDBM337851

COC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)C(C)C

BDBM337995

COC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)N(C)C

BDBM337853

COC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)N1CCCC1

BDBM346198

COC(=O)Nc1cc(ccn1)-c1cnc(OC)c2n(ccc12)S(=O)(=O)c1ccccc1

BDBM346187

COC(=O)Nc1cc(ccn1)-c1cnc(OC)c2n(ccc12)S(C)(=O)=O

BDBM337855

COC(=O)Nc1cc(ccn1)-c1cnc2[nH]ncc2c1

BDBM337859

COC(=O)Nc1cc(ccn1)-c1cnc2ccn(CC3CC3)c2c1

BDBM338004

COC(=O)Nc1cc(ccn1)-c1cncc(c1)C(=O)C1CC1

BDBM338152

COC(=O)Nc1cc(ccn1)-c1cncc(c1)S(=O)(=O)N1CCOCC1

BDBM346216

COC(=O)Nc1cc(ccn1)-c1cncc2n(ccc12)S(=O)(=O)C1CC1

BDBM346205

COC(=O)Nc1cc(ccn1)-c1cncc2n(ccc12)S(=O)(=O)N(C)C

BDBM346214

COC(=O)Nc1cc(ccn1)-c1cncc2n(ccc12)S(=O)(=O)c1ccccc1

BDBM346215

COC(=O)Nc1cc(ccn1)-c1cncc2n(ccc12)S(C)(=O)=O

BDBM50439712

COC(=O)c1ccc2nc(NC(C)=O)sc2c1

BDBM532977

COC(C)(C)C1CCCN1c1cc(cc(=O)[nH]1)-c1ccnc(NC(C)=O)c1

BDBM527941

COC(C)(C)C1CCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM527942

COC(C)(C)[C@@H]1CCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM527943

COC(C)(C)[C@H]1CCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM295133

COC1(C)CN(C1)S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1

BDBM295115

COC1(C)CN(C1)S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1nc(C)no1

BDBM295076

COCC(NS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1)C(C)C

BDBM295082

COCC1CCN(CC1)S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1

BDBM590181

COCCS(=O)(=O)N1CCN(C(C1)C(F)(F)F)c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM50506327

COCCS(=O)(=O)Nc1cc(cnc1OC)-c1cc2COCc2c(OC[C@@H](C)N2CCC(CC2)C(C)(C)O)c1 |r|

BDBM50506332

COCCS(=O)(=O)Nc1cc(cnc1OC)-c1cc2COCc2c(OC[C@H](C)N2CCC(CC2)C(C)(C)O)c1 |r|

BDBM50506315

COCCS(=O)(=O)Nc1cc(cnc1OC)-c1cc2COCc2c(OC[C@H]2CN(CCO2)C2COC2)c1 |r|

BDBM50506328

COCCS(=O)(=O)Nc1cc(cnc1OC)-c1cc2COCc2c(O[C@@H](C)CN2CCC(CC2)C(C)(C)O)c1 |r|

BDBM50550684

COC[C@@H](C)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|

BDBM295084

COC[C@@H]1COCCN1S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1 |r|

BDBM548286

COC[C@@]1(CNC(=O)c2cc(nn12)N1CCOC[C@H]1C)C(C)C |r|

BDBM548285

COC[C@]1(CNC(=O)c2cc(nn12)N1CCOC[C@H]1C)C(C)C |r|

BDBM295135

CON(C)S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1

BDBM295161

CONS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1nc(C)no1

BDBM50092783

CO[C@H]1CC[C@@H](CC1)N1C(=O)CNc2ncc(nc12)-c1ccc(nc1)C(C)(C)O |r,wU:2.1,wD:5.8,(2.39,-8.32,;1.33,-7.7,;1.33,-6.16,;-.01,-5.39,;-0,-3.85,;1.33,-3.08,;2.66,-3.85,;2.66,-5.39,;1.33,-1.54,;2.66,-.77,;3.73,-1.38,;2.66,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;,-.77,;-4.01,-1.54,;-4.01,-3.08,;-5.35,-3.85,;-6.68,-3.08,;-6.68,-1.54,;-5.35,-.77,;-8.02,-3.85,;-9.08,-3.23,;-9.08,-4.47,;-8.02,-5.08,)|

BDBM337966

COc1cc(C)ccc1S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM337983

COc1cc(F)c(cc1F)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM337875

COc1cc(F)ccc1S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM50197062

COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1

BDBM50336865

COc1ccc(Nc2cc(nc(n2)N2CCOCC2)-c2cnc(N)nc2)cn1

BDBM50394846

COc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1

BDBM337987

COc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM337989

COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM66431

COc1ccc(cc1Cl)N(C(C(=O)NCCc1ccccc1)c1cccs1)C(=O)CCl

BDBM50160073

COc1ccc(cc1S(=O)(=O)NCCO)-c1sc(NC(=O)C(C)(C)C)nc1C

BDBM50160067

COc1ccc(cc1S(=O)(=O)NCCO)-c1sc(NC(C)=O)nc1C

BDBM50160075

COc1ccc(cc1S(=O)(=O)Nc1ccc(O)cc1)-c1sc(NC(=O)C(C)(C)C)nc1C

BDBM50160074

COc1ccc(cc1S(=O)(=O)Nc1ccc(O)cc1)-c1sc(NC(=O)C2CCCC2)nc1C

BDBM50188961

COc1ccc(cn1)-c1nc(N2CCOCC2)c2sc(CN(C)c3ncc(cn3)C(=O)NO)cc2n1

BDBM81368

COc1ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc2c1OC |c:22,t:6|

BDBM50550657

COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1

BDBM50571452

COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(O)nc(n1)N1CCOCC1

BDBM50571446

COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(cc(=O)[nH]1)N1CCOCC1

BDBM50571447

COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(cc(=O)n1C)N1CCOCC1

BDBM50571450

COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(cc(OC)n1)N1CCOCC1

BDBM50571453

COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(nc(O)n1)N1CCOCC1

BDBM50571451

COc1ccc2Sc3c(Cc2c1)cccc3-c1nc(O)cc(n1)N1CCOCC1

BDBM527937

COc1cccc(c1)C1CCCN1c1cc(cc(=O)[nH]1)N1CCOCC1C

BDBM527959

COc1cccc(c1)C1CCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM337947

COc1cccc(c1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM528011

COc1cccc(c1)[C@@H]1CCCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM527960

COc1cccc(c1)[C@@H]1CCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM528012

COc1cccc(c1)[C@H]1CCCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM527961

COc1cccc(c1)[C@H]1CCCN1c1cc(cc(=O)[nH]1)N1CCOC[C@H]1C |r|

BDBM337893

COc1ccccc1S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1

BDBM50396810

COc1cncc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)c1

BDBM338194

COc1nc(C)nc(Nc2cc(ccn2)-c2cnc(C)c(NS(=O)(=O)c3ccc(F)cc3F)c2)n1

BDBM50396812

COc1ncc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F

BDBM50396813

COc1ncc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1

BDBM50396806

COc1ncc(Nc2ncc(CN3CCN(C[C@@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|

BDBM50396807

COc1ncc(Nc2ncc(CN3CCN(C[C@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|

BDBM50396818

COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N2CCN(CC2)S(C)(=O)=O)cc1F

BDBM50396808

COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|

BDBM50396820

COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|

BDBM50396822

COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(C[C@H]2C)S(C)(=O)=O)cc1F |r|

BDBM50396805

COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](N2CCN(CC2)S(C)(=O)=O)C(F)(F)F)cc1F |r|

BDBM50396809

COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|

BDBM50396819

COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|

BDBM50396821

COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(C[C@H]2C)S(C)(=O)=O)cc1F |r|

BDBM50396804

COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](N2CCN(CC2)S(C)(=O)=O)C(F)(F)F)cc1F |r|

BDBM338093

COc1ncc(c(C)c1NS(=O)(=O)N(C)C)-c1ccnc(NC(C)=O)c1

BDBM338073

COc1ncc(c(C)c1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM338258

COc1ncc(c(C)c1S(=O)(=O)NC(C)(C)C)-c1ccnc(NC(C)=O)c1

BDBM50156300

COc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccncc2)n1

BDBM337951

COc1ncc(cc1C(=O)N(C)C)-c1ccnc(NC(C)=O)c1

BDBM338239

COc1ncc(cc1C(=O)N(C)c1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM338077

COc1ncc(cc1C(=O)N(C)c1ccc(F)cc1F)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338151

COc1ncc(cc1N(C)C(=O)c1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM338168

COc1ncc(cc1NC(=O)c1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM338045

COc1ncc(cc1NS(=O)(=O)N(C)C)-c1ccnc(NC(C)=O)c1

BDBM337923

COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM50506331

COc1ncc(cc1NS(C)(=O)=O)-c1cc2COCCc2c(OCCN2CCC(CC2)C(C)(C)O)c1

BDBM50506323

COc1ncc(cc1NS(C)(=O)=O)-c1cc2COCc2c(OCCN2CCC(CC2)C(C)(C)O)c1

BDBM50506329

COc1ncc(cc1NS(C)(=O)=O)-c1cc2COCc2c(OC[C@H]2CN(CC(C)(C)O)CCO2)c1 |r|

BDBM50506320

COc1ncc(cc1NS(C)(=O)=O)-c1cc2COCc2c(OC[C@H]2CN(CCO2)C2COC2)c1 |r|

BDBM338285

COc1ncc(cc1S(=O)(=O)NC12CC(C1)C2)-c1ccnc(NC(C)=O)c1

BDBM338242

COc1ncc(cc1S(=O)(=O)NC1CCC1)-c1ccnc(NC(C)=O)c1

BDBM338049

COc1ncc(cc1S(=O)(=O)NC1CCC1)-c1ccnc(Nc2ccnc(C)n2)c1

BDBM338248

COc1ncc(cc1S(=O)(=O)Nc1cc(Cl)ccc1Cl)-c1ccnc(NC(C)=O)c1

BDBM338178

COc1ncc(cc1S(=O)(=O)Nc1cc(F)ccc1F)-c1ccnc(NC(C)=O)c1

BDBM338166

COc1ncc(cc1S(=O)(=O)Nc1ccc(Cl)cc1Cl)-c1ccnc(NC(C)=O)c1

BDBM337926

COc1ncc(cc1S(=O)(=O)Nc1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1

BDBM338149

COc1ncc(cc1S(=O)(=O)Nc1cccc(c1)C(F)(F)F)-c1ccnc(NC(C)=O)c1

BDBM337856

COc1ncc(cc1S(=O)(=O)Nc1ccccc1)-c1ccnc(NC(C)=O)c1

BDBM50573155

COc1ncc(cc1S(=O)(=O)Nc1cncc(c1)C#CCN1CCN(CC1)C(C)C)C1=CCOCC1 |t:33|

BDBM50555463

COc1ncc(cn1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1

BDBM338050

COc1nccc(Nc2cc(ccn2)-c2cnc(Cl)c(NS(=O)(=O)c3ccc(F)cc3F)c2C)n1

BDBM338055

COc1nccc(Nc2cc(ccn2)-c2cnc(N)c(c2)C(=O)N(C)C23CC(C2)C3)n1

BDBM338070

COc1nccc(Nc2cc(ccn2)-c2cncc(c2)C(=O)N(C)C23CC(C2)C3)n1

BDBM580187

CS(=O)(=O)N1CCN(C(C1)C(F)(F)F)c1cc(cc(=O)[nH]1)-c1ccnc2[nH]ncc12

BDBM25028

CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1

BDBM50338197

CS(=O)(=O)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1

BDBM346218

CS(=O)(=O)n1ccc2c(cncc12)-c1ccnc(N)c1

BDBM346197

CS(=O)(=O)n1ccc2c(cncc12)-c1ccnc(Nc2ncco2)c1

BDBM489258

C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(=O)(=O)NC1COC1)-c1sc(Nc2cccc(n2)N2CCOCC2=O)nc1C |r|

BDBM50274638

C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(NC(C)=O)nc1C |r|

BDBM50512861

C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCCC2=O)nc1C |r|

BDBM50579668

C[C@@H](C1CC1)N1Cc2cc-3cc(c2C1=O)S(=O)(=O)NCCOCCNC(=O)c1cccc(Nc2nc(C)c-3s2)n1 |r|

BDBM548287

C[C@@H](C1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C)c1ccccc1 |r|

BDBM548301

C[C@@H](CO)C1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM548300

C[C@@H](CO)[C@@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM295093

C[C@@H](O)CNS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1 |r|

BDBM548289

C[C@@H]([C@@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C)c1ccccc1 |r|

BDBM50112822

C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc2CCc3cnc(nc3-c2s1)C(C)(C)C |r|

BDBM50112816

C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc2CCc3sc(nc3-c2s1)C(C)(C)C |r|

BDBM50571476

C[C@@H]1CCN([C@H]1Cc1ccccc1)c1nc(cc(=O)[nH]1)N1CCOCC1 |r|

BDBM50571469

C[C@@H]1CN(CCO1)c1cc(=O)[nH]c(n1)N1CCCCC[C@@H]1Cc1ccccc1 |r|

BDBM50571468

C[C@@H]1CN(CCO1)c1cc([nH]c(=O)c1)N1CCCCC[C@@H]1Cc1ccccc1 |r|

BDBM50597811

C[C@@H]1CNC(=O)c2cc(nn12)-c1ccnc(NC(=O)C2CC2)c1 |r|

BDBM50612806

C[C@@H]1COCCC1c1cc(=O)n2CC[C@H](N(Cc3cncc(Cl)c3)c2n1)C(F)(F)F |r|

BDBM295071

C[C@@H]1COCCN1S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1 |r|

BDBM50121212

C[C@@H]1COCCN1c1cc(=O)n2CC[C@H](N(Cc3cncc(Cl)c3)c2n1)C(F)(F)F |r|

BDBM528007

C[C@@H]1COCCN1c1cc(N2CCCC[C@@H]2C(F)(F)F)n(C)c(=O)c1 |r|

BDBM510511

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1c(C)ccc2ncccc12 |r|

BDBM510503

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1cc(F)ccc1Cl |r|

BDBM510512

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1ccc(cc1)-c1ccn[nH]1 |r|

BDBM590190

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1ccc(cc1C(F)(F)F)S(=O)(=O)N(C)C |r|

BDBM590189

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1ccc(cc1C(F)(F)F)S(C)(=O)=O |r|

BDBM510504

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1ccccc1C |r|

BDBM510507

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1ccccc1C(F)(F)F |r|

BDBM510506

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1ccccc1Cl |r|

BDBM510510

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1ccccc1NS(C)(=O)=O |r|

BDBM510505

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1cccnc1C(F)(F)F |r|

BDBM510508

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1ccoc1 |r|

BDBM510509

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)-c1cscc1C |r|

BDBM527940

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1C(=O)N(C)C |r|

BDBM527944

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1C1CCCCC1 |r|

BDBM527968

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1cc(C)n(C)n1 |r|

BDBM528004

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1cc(C)on1 |r|

BDBM527950

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1cc(F)ccc1F |r|

BDBM527974

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1ccc(C)o1 |r|

BDBM527996

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1cccc(Cl)c1 |r|

BDBM527947

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1cccc(F)c1 |r|

BDBM527953

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1cccc(OC(F)(F)F)c1 |r|

BDBM527956

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1cccc(c1)C(F)(F)F |r|

BDBM527999

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1cccc(c1)C1CC1 |r|

BDBM527962

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1ccccc1 |r|

BDBM528000

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1ccccn1 |r|

BDBM527965

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1cnn(C)c1 |r|

BDBM528003

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC1c1nccs1 |r|

BDBM527981

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCCC1C(F)(F)F |r|

BDBM527983

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC[C@@H]1C(F)(F)F |r|

BDBM527990

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC[C@@H]1c1ccccc1 |r|

BDBM527982

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCCC[C@H]1C(F)(F)F |r|

BDBM527995

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1C(F)(F)F |r|

BDBM527946

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1C1CCCCC1 |r|

BDBM527970

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1cc(C)n(C)n1 |r|

BDBM528006

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1cc(C)on1 |r|

BDBM527952

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1cc(F)ccc1F |r|

BDBM527976

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1ccc(C)o1 |r|

BDBM527998

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1cccc(Cl)c1 |r|

BDBM527949

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1cccc(F)c1 |r|

BDBM527955

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1cccc(OC(F)(F)F)c1 |r|

BDBM527958

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1cccc(c1)C(F)(F)F |r|

BDBM527977

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1cccc(c1)N(C)C |r|

BDBM527964

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1ccccc1 |r|

BDBM528002

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1ccccn1 |r|

BDBM527967

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@@H]1c1cnn(C)c1 |r|

BDBM527994

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1C(F)(F)F |r|

BDBM527945

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1C1CCCCC1 |r|

BDBM527969

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1cc(C)n(C)n1 |r|

BDBM528005

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1cc(C)on1 |r|

BDBM527951

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1cc(F)ccc1F |r|

BDBM527975

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1ccc(C)o1 |r|

BDBM527997

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1cccc(Cl)c1 |r|

BDBM527948

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1cccc(F)c1 |r|

BDBM527954

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1cccc(OC(F)(F)F)c1 |r|

BDBM527957

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1cccc(c1)C(F)(F)F |r|

BDBM527963

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1ccccc1 |r|

BDBM528001

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1ccccn1 |r|

BDBM527966

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCC[C@H]1c1cnn(C)c1 |r|

BDBM528018

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(C)CC1C(F)(F)F |r|

BDBM527991

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(C)CC1c1ccccc1 |r|

BDBM527989

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1)C(C)=O |r|

BDBM528015

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)C(=O)Cc1ccc(F)cc1 |r|

BDBM528014

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)C(=O)c1cncc(F)c1 |r|

BDBM528013

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)C(C)=O |r|

BDBM590188

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)C1(C)CC1 |r|

BDBM590184

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)C1CC1 |r|

BDBM590176

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)C1CCOC1 |r|

BDBM590178

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)Cc1ccc(F)cc1 |r|

BDBM590179

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)N(C)C |r|

BDBM590180

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)N1CCCC1 |r|

BDBM590185

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)N1CCCCC1 |r|

BDBM590186

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)N1CCOCC1 |r|

BDBM590182

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|

BDBM590183

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)c1ccnn1C |r|

BDBM590187

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)c1cn(C)c(C)n1 |r|

BDBM590177

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(CC1C(F)(F)F)S(=O)(=O)c1cncc(F)c1 |r|

BDBM528017

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(C[C@@H]1C(F)(F)F)C(=O)C1CCCO1 |r|

BDBM590175

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(C[C@@H]1C(F)(F)F)S(C)(=O)=O |r|

BDBM528016

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(C[C@H]1C(F)(F)F)C(=O)C1CCCO1 |r|

BDBM590174

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCN(C[C@H]1C(F)(F)F)S(C)(=O)=O |r|

BDBM528008

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOCC11CCC1 |r|

BDBM527978

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOCC1C |r|

BDBM527992

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOCC1C(F)(F)F |r|

BDBM527993

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOCC1C1CC1 |r|

BDBM527984

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOCC1c1ccccc1 |r|

BDBM527979

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOC[C@@H]1C |r|

BDBM528010

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOC[C@@H]1C(F)(F)F |r|

BDBM527986

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOC[C@@H]1c1ccccc1 |r|

BDBM527980

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOC[C@H]1C |r|

BDBM528009

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOC[C@H]1C(F)(F)F |r|

BDBM527985

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCOC[C@H]1c1ccccc1 |r|

BDBM527988

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCS(=O)(=O)CC1 |r|

BDBM527987

C[C@@H]1COCCN1c1cc([nH]c(=O)c1)N1CCS(=O)CC1 |r|

BDBM548273

C[C@@H]1COCCN1c1cc2C(=O)NC(C)(C)[C@@H](C3CC3)n2n1 |r|

BDBM548274

C[C@@H]1COCCN1c1cc2C(=O)NC(C)(C)[C@H](C3CC3)n2n1 |r|

BDBM548265

C[C@@H]1COCCN1c1cc2C(=O)NC3(CC3)[C@@H](C3CC3)n2n1 |r|

BDBM548263

C[C@@H]1COCCN1c1cc2C(=O)NC3(CC3)[C@@](C)(C3CC3)n2n1 |r|

BDBM548266

C[C@@H]1COCCN1c1cc2C(=O)NC3(CC3)[C@H](C3CC3)n2n1 |r|

BDBM548264

C[C@@H]1COCCN1c1cc2C(=O)NC3(CC3)[C@](C)(C3CC3)n2n1 |r|

BDBM548303

C[C@@H]1COCCN1c1cc2C(=O)NCC(C)(C)n2n1 |r|

BDBM50597816

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@H](C3CC3)n2n1 |r|

BDBM548237

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@H](C3CCC3)n2n1

BDBM548241

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@H](C3CCCC3)n2n1

BDBM548291

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@H](CC(F)(F)F)n2n1 |r|

BDBM548240

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@H](n2n1)C(C)(C)C

BDBM548248

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@H](n2n1)C(C)(C)O |r|

BDBM548250

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@H](n2n1)C(F)(F)C(F)(F)F |r|

BDBM548252

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@H](n2n1)C(F)(F)F |r|

BDBM548246

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@H](n2n1)C1(C)CC1 |r|

BDBM548281

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@H](n2n1)C1(CC1)c1ccccc1 |r|

BDBM548257

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@](C)(C3CC3)n2n1 |r|

BDBM548276

C[C@@H]1COCCN1c1cc2C(=O)NC[C@@](C)(C3CCC3)n2n1

BDBM548238

C[C@@H]1COCCN1c1cc2C(=O)NC[C@H](C3CCC3)n2n1

BDBM548242

C[C@@H]1COCCN1c1cc2C(=O)NC[C@H](C3CCCC3)n2n1

BDBM548292

C[C@@H]1COCCN1c1cc2C(=O)NC[C@H](CC(F)(F)F)n2n1 |r|

BDBM548239

C[C@@H]1COCCN1c1cc2C(=O)NC[C@H](n2n1)C(C)(C)C

BDBM548247

C[C@@H]1COCCN1c1cc2C(=O)NC[C@H](n2n1)C(C)(C)O |r|

BDBM548249

C[C@@H]1COCCN1c1cc2C(=O)NC[C@H](n2n1)C(F)(F)C(F)(F)F |r|

BDBM548251

C[C@@H]1COCCN1c1cc2C(=O)NC[C@H](n2n1)C(F)(F)F |r|

BDBM548245

C[C@@H]1COCCN1c1cc2C(=O)NC[C@H](n2n1)C1(C)CC1 |r|

BDBM548280

C[C@@H]1COCCN1c1cc2C(=O)NC[C@H](n2n1)C1(CC1)c1ccccc1 |r|

BDBM548258

C[C@@H]1COCCN1c1cc2C(=O)NC[C@](C)(C3CC3)n2n1 |r|

BDBM548277

C[C@@H]1COCCN1c1cc2C(=O)NC[C@](C)(C3CCC3)n2n1

BDBM548253

C[C@@H]1COCCN1c1cc2C(=O)N[C@@H](C)[C@@H](C3CC3)n2n1 |r|

BDBM548256

C[C@@H]1COCCN1c1cc2C(=O)N[C@@H](C)[C@H](C3CC3)n2n1 |r|

BDBM548271

C[C@@H]1COCCN1c1cc2C(=O)N[C@@H](C3CC3)[C@@H](C3CC3)n2n1 |r|

BDBM548283

C[C@@H]1COCCN1c1cc2C(=O)N[C@@H](CC(F)(F)F)Cn2n1 |r|

BDBM548270

C[C@@H]1COCCN1c1cc2C(=O)N[C@@H](Cn2n1)C(F)(F)F |r|

BDBM548244

C[C@@H]1COCCN1c1cc2C(=O)N[C@@H]3CCC[C@@H]3n2n1 |r|

BDBM548275

C[C@@H]1COCCN1c1cc2C(=O)N[C@@H]3[C@@H](CCC3(C)C)n2n1 |r|

BDBM548255

C[C@@H]1COCCN1c1cc2C(=O)N[C@H](C)[C@@H](C3CC3)n2n1 |r|

BDBM548254

C[C@@H]1COCCN1c1cc2C(=O)N[C@H](C)[C@H](C3CC3)n2n1 |r|

BDBM548272

C[C@@H]1COCCN1c1cc2C(=O)N[C@H](C3CC3)[C@H](C3CC3)n2n1 |r|

BDBM548284

C[C@@H]1COCCN1c1cc2C(=O)N[C@H](CC(F)(F)F)Cn2n1 |r|

BDBM548269

C[C@@H]1COCCN1c1cc2C(=O)N[C@H](Cn2n1)C(F)(F)F |r|

BDBM548243

C[C@@H]1COCCN1c1cc2C(=O)N[C@H]3CCC[C@H]3n2n1 |r|

BDBM50559197

C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC1(C)C |r|

BDBM50559193

C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@@H](C)COC[C@H]1C |r|

BDBM106870

C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|

BDBM50537742

C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

BDBM548288

C[C@H](C1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C)c1ccccc1 |r|

BDBM50550673

C[C@H](CN1CCOCC1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|

BDBM50550669

C[C@H](CN1C[C@H](C)O[C@H](C)C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|

BDBM548302

C[C@H](CO)C1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM548299

C[C@H](CO)[C@@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C |r|

BDBM50192880

C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r|

BDBM295078

C[C@H](NS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1)C1CC1 |r|

BDBM602728

C[C@H](Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccccc2C1 |r|

BDBM217352

C[C@H](Nc1ncnc2[nH]cnc12)c1nc2ccc(F)cc2c(=O)n1-c1ccccc1 |r|

BDBM50358204

C[C@H](O)C(=O)N1CCN(Cc2sc3c(nc(nc3c2C)-c2cnc(N)nc2)N2CCOCC2)CC1 |r|

BDBM295113

C[C@H](O)CNS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1 |r|

BDBM548290

C[C@H]([C@@H]1CNC(=O)c2cc(nn12)N1CCOC[C@H]1C)c1ccccc1 |r|

BDBM50059640

C[C@H]1CN(CC(=O)Nc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)C[C@@H](C)O1

BDBM295225

C[C@H]1CN(C[C@@H]1O)S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1 |r|

BDBM295070

C[C@H]1COCCN1S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1cc(C)no1 |r|

BDBM60631

C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1 |r|

BDBM50429867

Cc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc(N)nc1)S(C)(=O)=O

BDBM338175

Cc1c(N)c(Cl)ncc1-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM338111

Cc1c(NS(=O)(=O)c2ccc(F)cc2F)c(Cl)ncc1-c1ccnc(N)c1

BDBM338079

Cc1c(NS(=O)(=O)c2ccc(F)cc2F)c(Cl)ncc1-c1ccnc(NC(=O)C2CC2(F)F)c1

BDBM338132

Cc1c(NS(=O)(=O)c2ccc(F)cc2F)c(Cl)ncc1-c1ccnc(NC(=O)C2CC2)c1

BDBM338088

Cc1c(NS(=O)(=O)c2ccc(F)cc2F)c(Cl)ncc1-c1ccnc(Nc2ccnc(n2)-c2ccccc2)c1

BDBM338120

Cc1c(NS(=O)(=O)c2ccc(F)cc2F)c(Cl)ncc1-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM338106

Cc1c(NS(=O)(=O)c2ccc(F)cc2F)c(Cl)ncc1-c1ccnc(Nc2ccncn2)c1

BDBM338124

Cc1c(NS(=O)(=O)c2ccc(F)cc2F)c(Cl)ncc1-c1ccnc(Nc2ncc(cn2)C#N)c1

BDBM338133

Cc1c(NS(=O)(=O)c2ccccc2)c(Cl)ncc1-c1ccnc(Nc2ccncn2)c1

BDBM338281

Cc1c(cnc(Cl)c1C(=O)N1CC(C)(C)C1)-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM338180

Cc1c(cnc(Cl)c1C(=O)N1CCC1)-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM338188

Cc1c(cnc(Cl)c1C(O)=O)-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM295176

Cc1c(cnn1C)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM364541

Cc1cc(-c2cncc(n2)-c2cc(ccc2C)S(=O)(=O)NC[C@@H]2C[C@H](O)C2)n(C)n1 |r,wU:22.23,24.26,(6.1,4.85,;4.77,4.08,;3.52,4.98,;2.27,4.08,;.94,4.85,;.94,6.39,;-.39,7.16,;-1.73,6.39,;-1.73,4.85,;-.39,4.08,;-3.06,4.08,;-3.06,2.54,;-4.39,1.77,;-5.73,2.54,;-5.73,4.08,;-4.39,4.85,;-4.39,6.39,;-4.39,.23,;-5.93,.23,;-2.85,.23,;-4.39,-1.31,;-5.73,-2.08,;-5.33,-3.57,;-6.1,-4.9,;-4.77,-5.67,;-4.37,-7.16,;-4,-4.34,;2.75,2.61,;1.98,1.28,;4.29,2.61,)|

BDBM50390409

Cc1cc(NC(=O)CCNC(=O)Nc2nc(C)c(s2)-c2ccc(cc2)-n2cccn2)no1

BDBM50612807

Cc1cc(Nc2cc(C)nc(Oc3ccc(cc3)[N+]([O-])=O)n2)n[nH]1

BDBM50612817

Cc1cc(Nc2cc(Cl)nc(OCc3ccc(cc3)[N+]([O-])=O)n2)n[nH]1

BDBM50543600

Cc1cc(Nc2cc(Cl)nc(Oc3ccc(cc3)[N+]([O-])=O)n2)n[nH]1

BDBM50612814

Cc1cc(Nc2cc(Cl)nc(Oc3ccc(cc3)[N+]([O-])=O)n2)no1

BDBM352640

Cc1cc(Nc2cc(ccn2)-c2cnc(C)c(NS(=O)(=O)c3ccc(F)cc3F)c2C)nc(C)n1

BDBM338096

Cc1cc(Nc2cc(ccn2)-c2cnc(Cl)c(NS(=O)(=O)c3ccc(F)cc3F)c2C)ccn1

BDBM338043

Cc1cc(Nc2cc(ccn2)-c2cnc(Cl)c(NS(=O)(=O)c3ccc(F)cc3F)c2C)nc(C)n1

BDBM50612818

Cc1cc(Nc2cc(nc(Nc3ccc(cc3)[N+]([O-])=O)n2)C(F)(F)F)n[nH]1

BDBM50612808

Cc1cc(Nc2cc(nc(Oc3ccc(cc3)[N+]([O-])=O)n2)C(F)(F)F)n[nH]1

BDBM50612809

Cc1cc(Nc2cc(nc(Oc3ccc(cc3)[N+]([O-])=O)n2)N2CCOCC2)n[nH]1

BDBM295062

Cc1cc(ccn1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM295193

Cc1cc(ccn1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](CO)CC1 |r,wU:25.27,wD:28.31,(8.67,3.46,;7.34,2.69,;6,3.47,;4.67,2.69,;4.67,1.16,;6,.38,;7.34,1.16,;3.33,3.47,;2,2.7,;.67,3.47,;.67,5,;2,5.77,;3.33,5,;4.67,5.78,;-.67,2.69,;-.67,1.15,;-2,.38,;-3.33,1.15,;-3.33,2.69,;-2,3.46,;-2,5,;-2,-1.16,;-3.54,-1.16,;-.46,-1.16,;-2,-2.7,;-3.33,-3.47,;-3.33,-5.01,;-4.67,-5.78,;-6,-5.01,;-7.34,-5.78,;-8.67,-5.01,;-6,-3.47,;-4.67,-2.69,)|

BDBM295035

Cc1cc(ccn1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:25.27,wD:28.31,(6.1,2.69,;4.77,1.92,;3.44,2.7,;2.1,1.92,;2.1,.39,;3.44,-.39,;4.77,.39,;.77,2.7,;-.56,1.93,;-1.9,2.7,;-1.9,4.24,;-.56,5,;.77,4.24,;2.1,5.01,;-3.23,1.92,;-3.23,.38,;-4.56,-.39,;-5.9,.38,;-5.9,1.92,;-4.56,2.69,;-4.56,4.23,;-4.56,-1.93,;-6.1,-1.93,;-3.02,-1.93,;-4.56,-3.47,;-3.23,-4.24,;-1.9,-3.47,;-.56,-4.24,;-.56,-5.78,;.77,-6.55,;-1.9,-6.55,;-3.23,-5.78,)|

BDBM352708

Cc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2F)c1C

BDBM295209

Cc1cc(on1)-c1cc(cnc1N)-c1cc(c(Cl)cc1C)S(=O)(=O)NCC(C)(C)O

BDBM295249

Cc1cc(on1)-c1cc(cnc1N)-c1cc(c(F)cc1C)S(=O)(=O)NCC(C)(C)O

BDBM295221

Cc1cc(on1)-c1cc(cnc1N)-c1cc(c(F)cc1C)S(=O)(=O)NOCC(C)(C)O

BDBM295141

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CC(C)(O)C1

BDBM295125

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CC(CO)C1

BDBM295066

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CC2(C1)CCOC2

BDBM295085

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CCCC(C)(O)CC1

BDBM295074

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CCCC1(C)C

BDBM295079

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CCC[C@H]1CO |r|

BDBM295081

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CCNC(=O)C1

BDBM295137

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CC[C@@H](O)C1 |r|

BDBM295073

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC(C)(C)C

BDBM295100

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC1

BDBM295224

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CCC[C@H]1O |r|

BDBM295067

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CCOC1=O

BDBM295121

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CCOCC1

BDBM295218

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC[C@@H](O)C1 |r|

BDBM295223

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1COC[C@H]1O |r|

BDBM295072

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)C

BDBM295120

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)CO

BDBM295051

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM295154

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(F)(F)F

BDBM295096

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(F)F

BDBM295063

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(C)COC1

BDBM295119

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCC1

BDBM295136

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCCC1

BDBM295116

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCCCC1

BDBM295114

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCOCC1

BDBM295165

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)COC1

BDBM295075

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CC1

BDBM295148

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CCC1

BDBM295168

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CCCC1

BDBM295122

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CCCCC1

BDBM295169

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CCOCC1

BDBM295094

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1COC1

BDBM295060

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM295127

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(F)(F)F

BDBM295129

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC1(O)CCCC1

BDBM295143

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC1(O)CCCCC1

BDBM295077

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC1CCOCC1

BDBM295188

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCO

BDBM295149

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@@H]1CCCCO1 |r|

BDBM295155

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@@H]1CCCO1 |r|

BDBM295091

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@@H]1CCCOC1 |r|

BDBM295153

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@@H]1CCOC1 |r|

BDBM295205

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@@H]1C[C@H](O)C1 |r,wU:25.27,27.30,(5.15,.82,;4.38,2.15,;2.92,2.63,;2.92,4.17,;4.38,4.64,;5.29,3.4,;1.59,4.94,;.25,4.17,;-1.08,4.94,;-1.08,6.48,;.25,7.25,;1.59,6.48,;2.92,7.25,;-2.42,4.17,;-2.42,2.63,;-3.75,1.86,;-5.08,2.63,;-5.08,4.17,;-3.75,4.94,;-3.75,6.48,;-3.75,.32,;-2.21,.32,;-5.29,.32,;-3.75,-1.22,;-2.42,-1.99,;-2.42,-3.53,;-3.5,-4.62,;-2.42,-5.71,;-2.42,-7.25,;-1.33,-4.62,)|

BDBM295092

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@H]1CCCOC1 |r|

BDBM295039

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@H]1CCOC1 |r|

BDBM295087

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NOCC(C)(C)O

BDBM295089

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NO[C@@H]1CCOC1 |r|

BDBM295088

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NO[C@H]1CCOC1 |r|

BDBM295217

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NO[C@H]1C[C@H](O)C1 |r,wU:27.30,wD:25.27,(7.68,-1.27,;6.91,.07,;5.45,.54,;5.45,2.08,;6.91,2.56,;7.81,1.31,;4.11,2.85,;2.78,2.08,;1.44,2.85,;1.44,4.39,;2.78,5.16,;4.11,4.39,;5.45,5.16,;.11,2.08,;.11,.54,;-1.22,-.23,;-2.56,.54,;-2.56,2.08,;-1.22,2.85,;-1.22,4.39,;-1.22,-1.77,;.32,-1.77,;-2.76,-1.77,;-1.22,-3.31,;-2.56,-4.08,;-4.1,-4.08,;-5.19,-2.99,;-6.27,-4.08,;-7.81,-4.08,;-5.19,-5.16,)|

BDBM295228

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@@H](CO)C(F)(F)F |r|

BDBM295117

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@@H]1CCNC(=O)C1 |r|

BDBM295069

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@@H]1CNC[C@H]1O |r|

BDBM295111

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@@H]1C[C@H](O)C1 |r,wU:24.26,26.29,(5.5,-7.2,;4.73,-5.87,;3.19,-5.87,;2.71,-4.41,;3.96,-3.5,;5.2,-4.41,;1.38,-3.64,;.04,-4.41,;-1.29,-3.64,;-1.29,-2.1,;.04,-1.33,;1.38,-2.1,;2.71,-1.33,;-2.62,-4.41,;-2.62,-5.95,;-3.96,-6.72,;-5.29,-5.95,;-5.29,-4.41,;-3.96,-3.64,;-3.96,-2.1,;-3.96,-8.26,;-2.42,-8.26,;-5.5,-8.26,;-3.96,-9.8,;-2.62,-10.57,;-2.22,-12.05,;-.74,-11.66,;.6,-12.43,;-1.14,-10.17,)|

BDBM295227

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H](CO)C(F)(F)F |r|

BDBM295080

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CCC[C@H](O)C1 |r|

BDBM295068

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](N)CC1 |r,wU:27.30,wD:24.26,(7.39,-.1,;6.62,1.23,;5.08,1.23,;4.61,2.69,;5.85,3.6,;7.1,2.69,;3.27,3.47,;1.94,2.69,;.61,3.47,;.61,5,;1.94,5.78,;3.27,5,;4.61,5.78,;-.73,2.69,;-.73,1.15,;-2.06,.38,;-3.39,1.15,;-3.39,2.69,;-2.06,3.47,;-2.06,5,;-2.06,-1.15,;-3.6,-1.15,;-.52,-1.15,;-2.06,-2.69,;-3.39,-3.47,;-4.73,-2.69,;-6.06,-3.47,;-6.06,-5,;-7.39,-5.78,;-4.73,-5.78,;-3.39,-5,)|

BDBM295046

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(5.15,-.65,;4.38,.68,;2.92,1.16,;2.92,2.7,;4.38,3.17,;5.29,1.93,;1.59,3.47,;.25,2.7,;-1.08,3.47,;-1.08,5.01,;.25,5.78,;1.59,5.01,;2.92,5.78,;-2.42,2.7,;-2.42,1.16,;-3.75,.39,;-5.08,1.16,;-5.08,2.7,;-3.75,3.47,;-3.75,5.01,;-3.75,-1.15,;-5.29,-1.15,;-2.21,-1.15,;-3.75,-2.69,;-2.42,-3.46,;-1.08,-2.69,;.25,-3.46,;.25,-5,;1.59,-5.77,;-1.08,-5.78,;-2.42,-5,)|

BDBM295112

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1C[C@H](O)C1 |r,wU:24.26,wD:26.29,(5.5,-7.2,;4.73,-5.87,;3.19,-5.87,;2.71,-4.41,;3.96,-3.5,;5.2,-4.41,;1.38,-3.64,;.04,-4.41,;-1.29,-3.64,;-1.29,-2.1,;.04,-1.33,;1.38,-2.1,;2.71,-1.33,;-2.62,-4.41,;-2.62,-5.95,;-3.96,-6.72,;-5.29,-5.95,;-5.29,-4.41,;-3.96,-3.64,;-3.96,-2.1,;-3.96,-8.26,;-2.42,-8.26,;-5.5,-8.26,;-3.96,-9.8,;-2.62,-10.57,;-1.14,-10.17,;-.74,-11.66,;.6,-12.43,;-2.22,-12.05,)|

BDBM295101

Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(N)(=O)=O

BDBM295251

Cc1cc(on1)-c1cc(cnc1N)-c1cccc(c1)S(=O)(=O)NCC(C)(C)O

BDBM295040

Cc1cc(sn1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM580166

Cc1cc2c(ccnc2[nH]1)-c1cc([nH]c(=O)c1)-c1ccccc1Cl

BDBM580163

Cc1cc2c(ccnc2[nH]1)-c1cc([nH]c(=O)c1)-c1cccnc1

BDBM580168

Cc1cc2c(ccnc2[nH]1)-c1cc([nH]c(=O)c1)N1CCCCC1C(F)(F)F

BDBM580133

Cc1cc2c(ccnc2[nH]1)-c1cc([nH]c(=O)c1)N1CCOCC1

BDBM338131

Cc1ccc(Nc2cc(ccn2)-c2cnc(C)c(NS(=O)(=O)c3ccc(F)cc3F)c2)nn1

BDBM50396815

Cc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1

BDBM338208

Cc1ccc(Oc2cc(cnc2C)-c2ccnc(Nc3ccnc(C)n3)c2)nc1

BDBM295104

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cc(CC(F)(F)F)no1)S(=O)(=O)NCC(C)(C)O

BDBM295156

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cc(CO)no1)S(=O)(=O)NCC(C)(C)O

BDBM295157

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cc(no1)C(=O)N1CCOCC1)S(=O)(=O)NCC(C)(C)O

BDBM295109

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cc(no1)C(C)(C)C)S(=O)(=O)NCC(C)(C)O

BDBM295106

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cc(no1)C(C)(C)C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:27.29,wD:30.33,(-4.24,5,;-4.24,3.46,;-5.57,2.69,;-5.57,1.15,;-4.24,.38,;-2.91,1.15,;-2.91,2.69,;-1.57,3.46,;-1.57,5,;-.24,5.77,;1.1,5,;2.43,5.77,;1.1,3.46,;-.24,2.69,;2.43,2.69,;2.43,1.15,;3.89,.68,;4.8,1.92,;3.89,3.17,;4.29,-.81,;5.78,-1.21,;3.2,-1.9,;4.69,-2.3,;-4.24,-1.15,;-2.7,-1.16,;-5.78,-1.15,;-4.24,-2.69,;-2.91,-3.46,;-1.57,-2.69,;-.24,-3.46,;-.24,-5,;1.1,-5.77,;-1.57,-5.77,;-2.91,-5,)|

BDBM295180

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cc(no1)C(F)(F)F)S(=O)(=O)NCC(C)(C)O

BDBM295107

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cc(no1)C1CC1)S(=O)(=O)NCC(C)(C)O

BDBM295173

Cc1ccc(cc1-c1cnc(N)c(c1)-c1ccn(C)c1)S(=O)(=O)NCC(C)(C)O

BDBM295250

Cc1ccc(cc1-c1cnc(N)c(c1)-c1ccn(C)n1)S(=O)(=O)NCC(C)(C)O

BDBM295064

Cc1ccc(cc1-c1cnc(N)c(c1)-c1ccncc1)S(=O)(=O)NCCC(C)(C)O

BDBM295179

Cc1ccc(cc1-c1cnc(N)c(c1)-c1ccno1)S(=O)(=O)NCC(C)(C)O

BDBM295178

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cn(C)nn1)S(=O)(=O)NCC(C)(C)O

BDBM295258

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnc(o1)C1CC1)S(=O)(=O)NCC(C)(C)O

BDBM295215

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnco1)S(=O)(=O)NCC(C)(C)O

BDBM295030

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)c1)S(=O)(=O)NCCC(C)(C)O

BDBM295033

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)c1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(-4.52,5,;-4.52,3.46,;-5.85,2.69,;-5.85,1.15,;-4.52,.38,;-3.19,1.15,;-3.19,2.69,;-1.85,3.47,;-1.85,5.01,;-.52,5.77,;.82,5.01,;2.15,5.78,;.82,3.47,;-.52,2.7,;2.15,2.69,;2.15,1.15,;3.61,.68,;4.52,1.92,;6.06,1.92,;3.61,3.17,;-4.52,-1.16,;-6.06,-1.16,;-2.98,-1.16,;-4.52,-2.7,;-3.19,-3.47,;-1.85,-2.7,;-.52,-3.47,;-.52,-5.01,;.82,-5.78,;-1.85,-5.78,;-3.19,-5.01,)|

BDBM295036

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)n1)S(=O)(=O)NCC(C)(C)O

BDBM295246

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)n1)S(=O)(=O)NCCC(C)(C)O

BDBM295037

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)n1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(-4.52,5,;-4.52,3.46,;-5.85,2.69,;-5.85,1.15,;-4.52,.38,;-3.19,1.15,;-3.19,2.69,;-1.85,3.47,;-1.85,5.01,;-.52,5.77,;.82,5.01,;2.15,5.78,;.82,3.47,;-.52,2.7,;2.15,2.69,;2.15,1.15,;3.61,.68,;4.52,1.92,;6.06,1.92,;3.61,3.17,;-4.52,-1.16,;-6.06,-1.16,;-2.98,-1.16,;-4.52,-2.7,;-3.19,-3.47,;-1.85,-2.7,;-.52,-3.47,;-.52,-5,;.82,-5.78,;-1.85,-5.77,;-3.19,-5,)|

BDBM295031

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(CC(F)(F)F)c1)S(=O)(=O)NCCC(C)(C)O

BDBM295103

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(CC(F)(F)F)c1)S(=O)(=O)NOCC(C)(C)O

BDBM295034

Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(CC(F)(F)F)c1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:28.30,wD:31.34,(-5.65,4.23,;-5.65,2.69,;-6.98,1.92,;-6.98,.38,;-5.65,-.39,;-4.31,.38,;-4.31,1.92,;-2.98,2.7,;-2.98,4.24,;-1.65,5,;-.31,4.24,;1.02,5.01,;-.31,2.7,;-1.65,1.93,;1.02,1.92,;1.02,.38,;2.49,-.09,;3.39,1.15,;4.93,1.15,;5.7,2.49,;4.93,3.82,;6.47,3.82,;7.19,2.09,;2.49,2.4,;-5.65,-1.93,;-7.19,-1.93,;-4.11,-1.93,;-5.65,-3.47,;-4.31,-4.24,;-2.98,-3.47,;-1.65,-4.24,;-1.65,-5.78,;-.31,-6.55,;-2.98,-6.55,;-4.31,-5.78,)|

BDBM295195

Cc1ccc(cc1-c1cnc(N)c(c1)-c1nc(CC(F)(F)F)no1)S(=O)(=O)NCCC(C)(C)O

BDBM295194

Cc1ccc(cc1-c1cnc(N)c(c1)-c1nc(CC(F)(F)F)no1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:28.30,wD:31.34,(-2.94,5,;-2.94,3.47,;-4.27,2.69,;-4.27,1.15,;-2.94,.38,;-1.61,1.15,;-1.61,2.69,;-.27,3.47,;-.27,5,;1.06,5.78,;2.4,5,;3.73,5.78,;2.4,3.47,;1.06,2.69,;3.73,2.69,;3.73,1.15,;5.19,.68,;5.96,-.65,;7.5,-.65,;8.27,-1.99,;8.27,.68,;6.73,.68,;6.1,1.93,;5.19,3.17,;-2.94,-1.15,;-1.4,-1.15,;-4.48,-1.15,;-2.94,-2.69,;-4.27,-3.47,;-4.27,-5,;-5.61,-5.78,;-6.94,-5,;-8.27,-5.78,;-6.94,-3.47,;-5.61,-2.69,)|

BDBM295186

Cc1ccc(cc1-c1cnc(N)c(c1)-c1nc(no1)C(F)F)S(=O)(=O)NCC(C)(C)O

BDBM295185

Cc1ccc(cc1-c1cnc(N)c(c1)-c1nc(no1)C(F)F)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:26.28,wD:29.32,(-2.34,5,;-2.34,3.46,;-3.68,2.69,;-3.68,1.15,;-2.34,.38,;-1.01,1.15,;-1.01,2.69,;.33,3.47,;.33,5,;1.66,5.77,;2.99,5,;4.33,5.78,;2.99,3.47,;1.66,2.7,;4.33,2.69,;4.33,1.15,;5.79,.68,;6.7,1.92,;5.79,3.17,;6.19,-.81,;5.1,-1.9,;7.68,-1.21,;-2.34,-1.16,;-3.88,-1.16,;-.8,-1.16,;-2.34,-2.7,;-3.68,-3.47,;-3.68,-5.01,;-5.01,-5.78,;-6.34,-5.01,;-7.68,-5.78,;-6.34,-3.47,;-5.01,-2.69,)|

BDBM295196

Cc1ccc(cc1-c1cnc(N)c(c1)-c1nc(no1)C1CC1)S(=O)(=O)NCC(C)(C)O

BDBM295216

Cc1ccc(cc1-c1cnc(N)c(c1)-c1ncco1)S(=O)(=O)NCC(C)(C)O

BDBM295197

Cc1ccc(cc1-c1cnc(N)c(c1)-n1cncn1)S(=O)(=O)NCC(C)(C)O

BDBM364539

Cc1ccc(cc1-c1cncc(n1)-c1cccnc1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:23.25,wD:26.29,(-2,5,;-2,3.47,;-3.33,2.69,;-3.33,1.15,;-2,.38,;-.67,1.15,;-.67,2.69,;.67,3.47,;.67,5,;2,5.78,;3.33,5,;3.33,3.47,;2,2.69,;4.67,2.69,;4.67,1.15,;6,.38,;7.34,1.15,;7.34,2.69,;6,3.47,;-2,-1.15,;-3.54,-1.15,;-.46,-1.15,;-2,-2.69,;-3.33,-3.47,;-3.33,-5,;-4.67,-5.78,;-6,-5,;-7.34,-5.78,;-6,-3.47,;-4.67,-2.69,)|

BDBM364537

Cc1ccc(cc1-c1cncc(n1)-c1cnn(CCN2CCOCC2)c1)S(=O)(=O)NCCC(C)(C)O

BDBM364540

Cc1ccc(cc1-c1cncc(n1)-c1csc(CN2CCOCC2)c1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:29.32,wD:32.36,(-4.16,5,;-4.16,3.47,;-5.5,2.69,;-5.5,1.15,;-4.16,.38,;-2.83,1.15,;-2.83,2.69,;-1.49,3.47,;-1.49,5,;-.16,5.78,;1.17,5,;1.17,3.47,;-.16,2.69,;2.51,2.69,;2.51,1.15,;3.97,.68,;4.88,1.93,;6.42,1.93,;7.19,.59,;6.42,-.74,;7.19,-2.08,;8.73,-2.08,;9.5,-.74,;8.73,.59,;3.97,3.17,;-4.16,-1.15,;-5.7,-1.15,;-2.62,-1.15,;-4.16,-2.69,;-5.5,-3.47,;-5.5,-5,;-6.83,-5.78,;-8.16,-5,;-9.5,-5.78,;-8.16,-3.47,;-6.83,-2.69,)|

BDBM580170

Cc1ccc(s1)-c1cc2c(ccnc2[nH]1)-c1cc([nH]c(=O)c1)N1CCOCC1C(F)(F)F

BDBM338060

Cc1ccc2ccc(Nc3cc(ccn3)-c3cnc(C)c(NS(=O)(=O)c4ccc(F)cc4F)c3)nc2n1

BDBM295099

Cc1cccc(NS(=O)(=O)c2ccc(C)c(c2)-c2cnc(N)c(c2)-c2cnn(C)c2)n1

BDBM295029

Cc1cccc(NS(=O)(=O)c2ccc(C)c(c2)-c2cnc(N)c(c2)-c2cnn(CC(F)(F)F)c2)n1

BDBM338100

Cc1cccc(Nc2cc(ccn2)-c2cnc(C)c(NS(=O)(=O)c3ccc(F)cc3F)c2)n1

BDBM338117

Cc1ccnc(Nc2cc(ccn2)-c2cnc(Cl)c(NS(=O)(=O)c3ccc(F)cc3F)c2C)n1

BDBM337821

Cc1cnc(NC(=O)C2CC2)cc1-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1

BDBM338246

Cc1cnc(NC(=O)C2CC2)cc1-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2F)c1C

BDBM295044

Cc1cnc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(7.96,1.93,;6.42,1.93,;5.51,.68,;4.05,1.15,;4.05,2.69,;5.51,3.17,;2.71,3.47,;1.38,2.69,;.05,3.47,;.05,5,;1.38,5.78,;2.71,5,;4.05,5.78,;-1.29,2.69,;-1.29,1.15,;-2.62,.38,;-3.96,1.15,;-3.96,2.69,;-2.62,3.47,;-2.62,5,;-2.62,-1.15,;-4.16,-1.15,;-1.08,-1.15,;-2.62,-2.69,;-3.96,-3.47,;-3.96,-5,;-5.29,-5.78,;-6.62,-5,;-7.96,-5.78,;-6.62,-3.47,;-5.29,-2.69,)|

BDBM295211

Cc1cnc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM295212

Cc1cnc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM580122

Cc1cnccc1-c1cc(cc(=O)[nH]1)-c1ccnc2[nH]ccc12

BDBM295175

Cc1cnn(c1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM50396817

Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc(=O)[nH]c1

BDBM50396816

Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc(Cl)nc1

BDBM50396814

Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc(nc1)C(F)(F)F

BDBM50396811

Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cncc(F)c1

BDBM50394889

Cc1nc(N)nc(n1)-c1cccnc1Nc1cccc2[nH]ccc12

BDBM50394890

Cc1nc(N)nc(n1)-c1cccnc1Nc1cccc2[nH]ncc12

BDBM50401269

Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1

BDBM535713

Cc1nc(N)sc1-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1

BDBM50160069

Cc1nc(NC(=O)C(C)(C)C)sc1-c1ccc(Cl)c(c1)S(=O)(=O)NCCO

BDBM50160070

Cc1nc(NC(=O)C2CCCC2)sc1-c1ccc(Cl)c(c1)S(=O)(=O)NCCO

BDBM50503134

Cc1nc(NC(=O)CN)sc1-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c1

BDBM50390408

Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccc(cc1)-n1cccn1 |r|

BDBM50436459

Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|

BDBM532276

Cc1nc(Nc2cc(ccn2)-c2cc([nH]c(=O)c2)-c2ccccc2C(F)(F)F)cs1

BDBM532273

Cc1nc(Nc2cc(ccn2)-c2cc([nH]c(=O)c2)N2CCOCC2C(F)(F)F)cs1

BDBM338201

Cc1nc(Nc2cc(ccn2)-c2cnc(C)c(NS(=O)(=O)c3ccc(F)cc3F)c2)nc(n1)C1CC1

BDBM338063

Cc1nc(Nc2cc(ccn2)-c2cnc(Cl)c(NS(=O)(=O)c3ccc(F)cc3F)c2C)ccc1C#N

BDBM295174

Cc1nc(cs1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM295214

Cc1nc(cs1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM295213

Cc1nc(cs1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:27.30,wD:24.26,(6.06,2.56,;4.52,2.56,;3.61,3.81,;2.15,3.33,;2.15,1.79,;3.61,1.32,;.82,4.1,;-.52,3.33,;-1.85,4.1,;-1.85,5.64,;-.52,6.41,;.82,5.64,;2.15,6.41,;-3.19,3.33,;-3.19,1.79,;-4.52,1.02,;-5.85,1.79,;-5.85,3.33,;-4.52,4.1,;-4.52,5.64,;-4.52,-.52,;-2.98,-.52,;-6.06,-.52,;-4.52,-2.06,;-3.43,-3.15,;-3.83,-4.63,;-2.74,-5.72,;-1.25,-5.32,;-.16,-6.41,;-.85,-3.84,;-1.94,-2.75,)|

BDBM346221

Cc1ncc(-c2ccnc(NC(=O)C3CC3(F)F)c2)c2ccn(c12)S(C)(=O)=O

BDBM346234

Cc1ncc(-c2ccnc(NC(=O)CO)c2)c2ccn(c12)S(=O)(=O)C1CC1

BDBM352660

Cc1ncc(c(C)c1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2ccc(C#N)c(C)n2)c1

BDBM338116

Cc1ncc(cc1C(=O)N1CCC1)-c1ccnc(Nc2ccnc(n2)C(F)(F)F)c1

BDBM338071

Cc1ncc(cc1C(=O)N1CCC1)-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM338187

Cc1ncc(cc1NC(=O)N1CC(F)(F)C1)-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM338257

Cc1ncc(cc1NS(=O)(=O)c1ccc(Cl)cc1F)-c1ccnc(NC(=O)C2CC2(F)F)c1

BDBM338249

Cc1ncc(cc1NS(=O)(=O)c1ccc(Cl)cc1F)-c1ccnc(NC(=O)C2CC2)c1

BDBM337833

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(=O)C2CC2(F)F)c1

BDBM338129

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(=O)C2CCC2)c1

BDBM338137

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(=O)N2CCCC2)c1

BDBM338146

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(=O)OCC2(C)COC2)c1

BDBM338148

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(=O)OCc2ccn(C)n2)c1

BDBM338113

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2ccc(C#N)c(C)n2)c1

BDBM338053

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2ccc(cn2)C#N)c1

BDBM338121

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2ccccn2)c1

BDBM338125

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2ccn(C)n2)c1

BDBM338062

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2ccnc(n2)C(F)(F)F)c1

BDBM338064

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2ccncn2)c1

BDBM338134

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2cnccn2)c1

BDBM338058

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2nc3ccccc3o2)c1

BDBM338095

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2nc3ccccc3s2)c1

BDBM338089

Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(Nc2ncccn2)c1

BDBM295255

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC(CO)C(F)(F)F

BDBM295242

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC1

BDBM295257

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CCC(O)(C1)C(F)(F)F

BDBM295232

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CCC(O)C1

BDBM295230

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)CO

BDBM295050

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM295237

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(F)(F)F

BDBM295238

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(F)F

BDBM295184

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(C)COC1

BDBM295241

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCOCC1

BDBM295182

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)COC1

BDBM295254

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CC1

BDBM295256

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CCOCC1

BDBM295235

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)COC1

BDBM295229

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1CC(O)C1 |(6.06,3.4,;4.52,3.4,;3.61,2.15,;2.15,2.63,;2.15,4.17,;3.61,4.64,;.82,4.94,;-.52,4.17,;-1.85,4.94,;-1.85,6.48,;-.52,7.25,;.82,6.48,;2.15,7.25,;-3.19,4.17,;-3.19,2.63,;-4.52,1.86,;-5.85,2.63,;-5.85,4.17,;-4.52,4.94,;-4.52,6.48,;-4.52,.32,;-6.06,.32,;-2.98,.32,;-4.52,-1.22,;-3.19,-1.99,;-3.19,-3.53,;-4.27,-4.62,;-3.19,-5.71,;-3.19,-7.25,;-2.1,-4.62,)|

BDBM295240

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1CC1

BDBM295236

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1CCCOC1

BDBM295231

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1COC1

BDBM295059

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM295234

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCCO

BDBM295233

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCO

BDBM295247

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NOCC(C)(C)O

BDBM295198

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@@H]1C[C@H](O)C1 |r,wU:24.26,26.29,(6.06,9.48,;4.52,9.48,;3.61,8.23,;2.15,8.71,;2.15,10.25,;3.61,10.72,;.82,11.02,;-.52,10.25,;-1.85,11.02,;-1.85,12.56,;-.52,13.33,;.82,12.56,;2.15,13.33,;-3.19,10.25,;-3.19,8.71,;-4.52,7.94,;-5.85,8.71,;-5.85,10.25,;-4.52,11.02,;-4.52,12.56,;-4.52,6.4,;-2.98,6.4,;-6.06,6.4,;-4.52,4.86,;-3.19,4.09,;-2.79,2.6,;-1.3,3,;.03,2.23,;-1.7,4.48,)|

BDBM295252

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CCC[C@H](O)C1 |r|

BDBM295239

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](CO)CC1 |r,wU:27.30,wD:24.26,(6.06,1.93,;4.52,1.93,;3.61,.68,;2.15,1.15,;2.15,2.69,;3.61,3.17,;.82,3.47,;-.52,2.69,;-1.85,3.47,;-1.85,5,;-.52,5.78,;.82,5,;2.15,5.78,;-3.19,2.69,;-3.19,1.15,;-4.52,.38,;-5.85,1.15,;-5.85,2.69,;-4.52,3.47,;-4.52,5,;-4.52,-1.15,;-6.06,-1.15,;-2.98,-1.15,;-4.52,-2.69,;-3.19,-3.47,;-3.19,-5,;-1.85,-5.78,;-.52,-5,;.82,-5.78,;2.15,-5,;-.52,-3.47,;-1.85,-2.69,)|

BDBM295220

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(7.96,1.92,;6.42,1.92,;5.51,.68,;4.05,1.15,;4.05,2.69,;5.51,3.17,;2.71,3.47,;1.38,2.7,;.05,3.47,;.05,5.01,;1.38,5.77,;2.71,5.01,;4.05,5.78,;-1.29,2.69,;-1.29,1.15,;-2.62,.38,;-3.96,1.15,;-3.96,2.69,;-2.62,3.46,;-2.62,5,;-2.62,-1.16,;-1.08,-1.16,;-4.16,-1.16,;-2.62,-2.7,;-3.96,-3.47,;-3.96,-5.01,;-5.29,-5.77,;-6.62,-5.01,;-7.96,-5.78,;-6.62,-3.47,;-5.29,-2.7,)|

BDBM295199

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1C[C@H](O)C1 |r,wU:24.26,wD:26.29,(6.06,9.48,;4.52,9.48,;3.61,8.23,;2.15,8.71,;2.15,10.25,;3.61,10.72,;.82,11.02,;-.52,10.25,;-1.85,11.02,;-1.85,12.56,;-.52,13.33,;.82,12.56,;2.15,13.33,;-3.19,10.25,;-3.19,8.71,;-4.52,7.94,;-5.85,8.71,;-5.85,10.25,;-4.52,11.02,;-4.52,12.56,;-4.52,6.4,;-2.98,6.4,;-6.06,6.4,;-4.52,4.86,;-3.19,4.09,;-1.7,4.48,;-1.3,3,;.03,2.23,;-2.79,2.6,)|

BDBM295102

Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(N)(=O)=O

BDBM295200

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC(CO)C1 |(6.06,3.4,;4.52,3.4,;3.61,2.15,;2.15,2.63,;2.15,4.17,;3.61,4.64,;.82,4.94,;-.52,4.17,;-1.85,4.94,;-1.85,6.48,;-.52,7.25,;.82,6.48,;2.15,7.25,;-3.19,4.17,;-3.19,2.63,;-4.52,1.86,;-5.85,2.63,;-5.85,4.17,;-4.52,4.94,;-4.52,6.48,;-4.52,.32,;-2.98,.32,;-6.06,.32,;-4.52,-1.22,;-4.52,-2.76,;-5.61,-3.85,;-4.52,-4.94,;-4.52,-6.48,;-3.19,-7.25,;-3.43,-3.85,)|

BDBM295097

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC2(CC(O)C2)C1 |(9.15,-3.6,;7.61,-3.6,;6.7,-4.85,;5.24,-4.37,;5.24,-2.83,;6.7,-2.36,;3.91,-2.06,;2.57,-2.83,;1.24,-2.06,;1.24,-.52,;2.57,.25,;3.91,-.52,;5.24,.25,;-.1,-2.83,;-1.43,-2.06,;-2.76,-2.83,;-2.76,-4.37,;-1.43,-5.14,;-.1,-4.37,;1.24,-5.14,;-4.1,-2.06,;-4.1,-.52,;-4.87,-3.4,;-5.43,-1.29,;-6.2,.04,;-7.69,.44,;-7.29,1.92,;-6.89,3.41,;-8.38,3.81,;-9.15,5.14,;-8.78,2.32,;-5.8,1.53,)|

BDBM295203

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)CO

BDBM295061

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM295183

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)COC1

BDBM295202

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)COC1

BDBM295201

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1COC1

BDBM295032

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM295055

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCCO

BDBM295204

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCO

BDBM295219

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:27.30,wD:24.26,(10.26,-1.16,;8.72,-1.16,;7.82,-2.4,;6.35,-1.92,;6.35,-.39,;7.82,.09,;5.02,.39,;3.69,-.39,;2.35,.39,;2.35,1.92,;3.69,2.69,;5.02,1.92,;6.35,2.69,;1.02,-.39,;-.31,.39,;-1.65,-.39,;-1.65,-1.92,;-.31,-2.69,;1.02,-1.92,;2.35,-2.69,;-2.98,.39,;-2.21,1.72,;-3.75,-.95,;-4.31,1.16,;-5.8,.76,;-6.89,1.85,;-8.38,1.45,;-8.78,-.04,;-10.26,-.44,;-7.69,-1.13,;-6.2,-.73,)|

BDBM295189

Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(N)(=O)=O

BDBM364529

Cc1ncc(s1)-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCCCO

BDBM364533

Cc1ncc(s1)-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:23.25,wD:26.29,(6.06,1.92,;4.52,1.92,;3.61,.68,;2.15,1.15,;2.15,2.69,;3.61,3.17,;.82,3.46,;.82,5,;-.52,5.78,;-1.85,5,;-1.85,3.46,;-.52,2.69,;-3.19,2.69,;-3.19,1.15,;-4.52,.38,;-5.85,1.15,;-5.85,2.69,;-4.52,3.46,;-4.52,5,;-4.52,-1.16,;-2.98,-1.16,;-6.06,-1.16,;-4.52,-2.7,;-3.19,-3.47,;-1.85,-2.7,;-.52,-3.47,;-.52,-5.01,;.82,-5.78,;-1.85,-5.78,;-3.19,-5.01,)|

BDBM338118

Cc1nccc(Nc2cc(c(F)cn2)-c2cnc(Cl)c(NS(=O)(=O)c3ccc(F)cc3F)c2C)n1

BDBM338269

Cc1nccc(Nc2cc(ccn2)-c2c[n+]([O-])c(Cl)c(NS(=O)(=O)c3ccc(F)cc3F)c2C)n1

BDBM338295

Cc1nccc(Nc2cc(ccn2)-c2cc(N)c3ccnn3c2)n1

BDBM338223

Cc1nccc(Nc2cc(ccn2)-c2cc(NC(=O)N3CC(F)(F)C3)c3ccnn3c2)n1

BDBM338301

Cc1nccc(Nc2cc(ccn2)-c2cc(NS(=O)(=O)c3ccc(F)cc3F)c3ccnn3c2)n1

BDBM532274

Cc1nccc(Nc2cc(ccn2)-c2cc([nH]c(=O)c2)-c2ccccc2C(F)(F)F)n1

BDBM532281

Cc1nccc(Nc2cc(ccn2)-c2cc([nH]c(=O)c2)-c2ccccc2Cl)n1

BDBM532278

Cc1nccc(Nc2cc(ccn2)-c2cc([nH]c(=O)c2)-c2cccnc2C(F)(F)F)n1

BDBM532277

Cc1nccc(Nc2cc(ccn2)-c2cc([nH]c(=O)c2)-c2cnccc2C)n1

BDBM532266

Cc1nccc(Nc2cc(ccn2)-c2cc([nH]c(=O)c2)N2CCCCC2C(F)(F)F)n1

BDBM532270

Cc1nccc(Nc2cc(ccn2)-c2cc([nH]c(=O)c2)N2CCN(CC2C(F)(F)F)S(=O)(=O)Cc2ccc(F)cc2)n1

BDBM532268

Cc1nccc(Nc2cc(ccn2)-c2cc([nH]c(=O)c2)N2CCOCC2C(F)(F)F)n1

BDBM338297

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(NC(=O)N3CC(F)(F)C3)c2)n1

BDBM338255

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(NC(=O)Nc3ccccc3)c2)n1

BDBM338074

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(NC(=O)c3ccc(F)cc3F)c2)n1

BDBM352716

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(NC(=O)c3ccc(F)cc3F)c2C)n1

BDBM338115

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(NS(=O)(=O)c3ccc(F)cc3F)c2)n1

BDBM338286

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(OC3CCCC3)c2)n1

BDBM338240

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(OCCO)c2)n1

BDBM338182

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(OCc3ccccc3)c2)n1

BDBM338290

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(Oc3ccccc3)c2)n1

BDBM338309

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(c2)C(=O)N2CC(C)(C)C2)n1

BDBM338046

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(c2)C(=O)N2CC(F)(F)C2)n1

BDBM338231

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(c2)C(=O)N2CC3(COC3)C2)n1

BDBM338128

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(c2)C(=O)N2CCC2)n1

BDBM338139

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(c2)C(=O)N2CCCC2)n1

BDBM338086

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(c2)C(=O)N2CCCCC2)n1

BDBM338109

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(c2)C(=O)NCC2CC2)n1

BDBM338048

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(c2)C(=S)N2CCC2)n1

BDBM338104

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(c2)C(N)=O)n1

BDBM338078

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c(c2)C(O)=O)n1

BDBM346237

Cc1nccc(Nc2cc(ccn2)-c2cnc(C)c3[nH]ccc23)n1

BDBM338272

Cc1nccc(Nc2cc(ccn2)-c2cnc(Cl)c(C(=O)N3CCC3)c2C)n1

BDBM338218

Cc1nccc(Nc2cc(ccn2)-c2cnc(Cl)c(C(O)=O)c2C)n1

BDBM338051

Cc1nccc(Nc2cc(ccn2)-c2cnc(Cl)c(N)c2C)n1

BDBM338119

Cc1nccc(Nc2cc(ccn2)-c2cnc(Cl)c(NC(=O)c3ccc(F)cc3F)c2C)n1

BDBM338123

Cc1nccc(Nc2cc(ccn2)-c2cnc(Cl)c(NS(=O)(=O)c3ccc(F)cc3F)c2C)n1

BDBM338057

Cc1nccc(Nc2cc(ccn2)-c2cnc(Cl)c(c2)C(=O)N2CCC2)n1

BDBM338067

Cc1nccc(Nc2cc(ccn2)-c2cnc(Cl)c(c2)S(=O)(=O)NC23CC(C2)C3)n1

BDBM338040

Cc1nccc(Nc2cc(ccn2)-c2cnc(Cl)c(c2)S(=O)(=O)NC2CCC2)n1

BDBM338103

Cc1nccc(Nc2cc(ccn2)-c2cnc(O)c(c2)S(=O)(=O)NC2CCC2)n1

BDBM338197

Cc1nccc(Nc2cc(ccn2)-c2cnc3CCN(Cc4ccccc4)C(=O)c3c2)n1

BDBM338222

Cc1nccc(Nc2cc(ccn2)-c2cnc3CCNC(=O)c3c2)n1

BDBM338256

Cc1nccc(Nc2cc(ccn2)-c2cncc(OC3CCc4c3cccc4F)c2)n1

BDBM338224

Cc1nccc(Nc2cc(ccn2)-c2cncc(c2)C(=O)N2CC(F)(F)C2)n1

BDBM295095

Cc1nn(C)cc1-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC2(CC(O)C2)C1 |(3.91,-5.14,;5.24,-4.37,;6.7,-4.85,;7.61,-3.6,;9.15,-3.6,;6.7,-2.36,;5.24,-2.83,;3.91,-2.06,;2.57,-2.83,;1.24,-2.06,;1.24,-.52,;2.57,.25,;3.91,-.52,;5.24,.25,;-.1,-2.83,;-1.43,-2.06,;-2.76,-2.83,;-2.76,-4.37,;-1.43,-5.14,;-.1,-4.37,;1.24,-5.14,;-4.1,-2.06,;-4.1,-.52,;-4.87,-3.4,;-5.43,-1.29,;-6.2,.04,;-7.69,.44,;-7.29,1.92,;-6.89,3.41,;-8.38,3.81,;-9.15,5.14,;-8.78,2.32,;-5.8,1.53,)|

BDBM364534

Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NC1CC2(CC(O)C2)C1 |(4.78,4.98,;4.38,3.49,;5.29,2.24,;4.38,1,;4.78,-.49,;2.92,1.47,;2.92,3.01,;1.59,3.78,;1.59,5.32,;.25,6.09,;-1.08,5.32,;-1.08,3.78,;.25,3.01,;-2.42,3.01,;-2.42,1.47,;-3.75,.7,;-5.08,1.47,;-5.08,3.01,;-3.75,3.78,;-3.75,5.32,;-3.75,-.84,;-2.21,-.84,;-5.29,-.84,;-3.75,-2.38,;-2.42,-3.15,;-2.02,-4.63,;-.53,-4.23,;-.13,-5.72,;1.36,-5.32,;2.69,-6.09,;.96,-3.84,;-.93,-2.75,)|

BDBM364536

Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)CO

BDBM364530

Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM364532

Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCC1(C)COC1

BDBM364531

Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM364535

Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NC[C@@H]1C[C@H](O)C1 |r,wU:25.27,27.30,(3.96,6.23,;3.96,4.69,;5.2,3.78,;4.73,2.32,;5.5,.99,;3.19,2.32,;2.71,3.78,;1.38,4.55,;1.38,6.09,;.04,6.86,;-1.29,6.09,;-1.29,4.55,;.04,3.78,;-2.62,3.78,;-2.62,2.24,;-3.96,1.47,;-5.29,2.24,;-5.29,3.78,;-3.96,4.55,;-3.96,6.09,;-3.96,-.07,;-2.42,-.07,;-5.5,-.07,;-3.96,-1.61,;-3.96,-3.15,;-2.87,-4.24,;-2.87,-5.78,;-1.33,-5.78,;-.24,-6.86,;-1.33,-4.24,)|

BDBM364538

Cc1nn(CCN2CCOCC2)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM295049

Cc1nnc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM295226

Cc1nnc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM295245

Cc1nnc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM295222

Cc1noc(n1)-c1cc(cnc1N)-c1cc(c(C)cc1C)S(=O)(=O)NCC(C)(C)O

BDBM295253

Cc1noc(n1)-c1cc(cnc1N)-c1cc(c(C)cc1F)S(=O)(=O)NCC(C)(C)O

BDBM295210

Cc1noc(n1)-c1cc(cnc1N)-c1cc(c(Cl)cc1C)S(=O)(=O)NCC(C)(C)O

BDBM295206

Cc1noc(n1)-c1cc(cnc1N)-c1cc(c(F)cc1C)S(=O)(=O)NCC(C)(C)O

BDBM295152

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CC(CO)C1

BDBM295145

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CC[C@H](O)C1 |r|

BDBM295134

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC(CO)C1CCOC1

BDBM295130

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC(F)(F)C1

BDBM295047

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC(O)C1 |(6.66,-.88,;5.89,.45,;6.8,1.7,;5.89,2.95,;4.43,2.47,;4.43,.93,;3.09,3.24,;1.76,2.47,;.43,3.24,;.43,4.78,;1.76,5.55,;3.09,4.78,;4.43,5.55,;-.91,2.47,;-.91,.93,;-2.24,.16,;-3.58,.93,;-3.58,2.47,;-2.24,3.24,;-2.24,4.78,;-2.24,-1.38,;-3.78,-1.38,;-.7,-1.38,;-2.24,-2.92,;-3.58,-3.69,;-5.06,-3.29,;-5.46,-4.78,;-6.8,-5.55,;-3.97,-5.18,)|

BDBM295052

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC2(CC(O)C2)C1 |(5.15,-.34,;4.38,1,;5.29,2.24,;4.38,3.49,;2.92,3.01,;2.92,1.47,;1.59,3.78,;.25,3.01,;-1.08,3.78,;-1.08,5.32,;.25,6.09,;1.59,5.32,;2.92,6.09,;-2.42,3.01,;-2.42,1.47,;-3.75,.7,;-5.08,1.47,;-5.08,3.01,;-3.75,3.78,;-3.75,5.32,;-3.75,-.84,;-2.21,-.84,;-5.29,-.84,;-3.75,-2.38,;-2.42,-3.15,;-2.02,-4.63,;-.53,-4.23,;-.13,-5.72,;1.36,-5.32,;2.69,-6.09,;.96,-3.84,;-.93,-2.75,)|

BDBM295164

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CCOCC1

BDBM295131

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)CO

BDBM295056

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM295151

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(F)F

BDBM295041

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(C)COC1

BDBM295139

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCC1

BDBM295126

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCCC1

BDBM295123

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCOCC1

BDBM295167

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)COC1

BDBM295132

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CC1

BDBM295128

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CCC1

BDBM295166

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CCOCC1

BDBM295171

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)COC1

BDBM295172

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1CCCO1

BDBM295098

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1CCOC1

BDBM295042

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O

BDBM295163

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(F)(F)F

BDBM295124

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC1(O)CCCC1

BDBM295144

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC1(O)CCCCC1

BDBM295142

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCN

BDBM295208

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@@H]1CCOC1 |r|

BDBM295118

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@H]1CCCO1 |r|

BDBM295207

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@H]1CCOC1 |r|

BDBM295162

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NOC(C)(C)C

BDBM295057

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NOCC(C)(C)O

BDBM295170

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NO[C@H]1C[C@H](O)C1 |r,wU:27.30,wD:25.27,(7.68,-1.27,;6.91,.07,;7.81,1.31,;6.91,2.56,;5.45,2.08,;5.45,.54,;4.11,2.85,;2.78,2.08,;1.44,2.85,;1.44,4.39,;2.78,5.16,;4.11,4.39,;5.45,5.16,;.11,2.08,;.11,.54,;-1.22,-.23,;-2.56,.54,;-2.56,2.08,;-1.22,2.85,;-1.22,4.39,;-1.22,-1.77,;.32,-1.77,;-2.76,-1.77,;-1.22,-3.31,;-2.56,-4.08,;-4.1,-4.08,;-5.19,-2.99,;-6.27,-4.08,;-7.81,-4.08,;-5.19,-5.16,)|

BDBM295138

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@@H]1CCNC(=O)C1 |r|

BDBM295191

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@@H]1C[C@H](CO)C1 |r,wU:24.26,26.29,(4.78,-6.84,;4.01,-5.51,;4.48,-4.05,;3.24,-3.14,;1.99,-4.05,;2.47,-5.51,;.66,-3.28,;-.68,-4.05,;-2.01,-3.28,;-2.01,-1.74,;-.68,-.97,;.66,-1.74,;1.99,-.97,;-3.34,-4.05,;-3.34,-5.59,;-4.68,-6.36,;-6.01,-5.59,;-6.01,-4.05,;-4.68,-3.28,;-4.68,-1.74,;-4.68,-7.9,;-6.22,-7.9,;-3.14,-7.9,;-4.68,-9.44,;-3.34,-10.21,;-2.94,-11.69,;-1.46,-11.29,;-.12,-12.06,;1.21,-11.29,;-1.86,-9.81,)|

BDBM295048

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@@H]1C[C@H](O)C1 |r,wU:24.26,26.29,(6.66,-.88,;5.89,.45,;6.8,1.7,;5.89,2.95,;4.43,2.47,;4.43,.93,;3.09,3.24,;1.76,2.47,;.43,3.24,;.43,4.78,;1.76,5.55,;3.09,4.78,;4.43,5.55,;-.91,2.47,;-.91,.93,;-2.24,.16,;-3.58,.93,;-3.58,2.47,;-2.24,3.24,;-2.24,4.78,;-2.24,-1.38,;-.7,-1.38,;-3.78,-1.38,;-2.24,-2.92,;-3.58,-3.69,;-5.06,-3.29,;-5.46,-4.78,;-6.8,-5.55,;-3.97,-5.18,)|

BDBM295053

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC2(C[C@H](O)C2)C1 |r,wU:24.26,28.31,(5.15,-7.55,;4.38,-6.22,;5.29,-4.97,;4.38,-3.73,;2.92,-4.2,;2.92,-5.74,;1.59,-3.43,;.25,-4.2,;-1.08,-3.43,;-1.08,-1.89,;.25,-1.12,;1.59,-1.89,;2.92,-1.12,;-2.42,-4.2,;-2.42,-5.74,;-3.75,-6.51,;-5.08,-5.74,;-5.08,-4.2,;-3.75,-3.43,;-3.75,-1.89,;-3.75,-8.05,;-2.21,-8.05,;-5.29,-8.05,;-3.75,-9.59,;-2.42,-10.36,;-.93,-9.97,;-.53,-11.45,;-.13,-12.94,;1.36,-12.54,;2.69,-13.31,;.96,-11.05,;-2.02,-11.85,)|

BDBM295065

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](CO)CC1 |r,wU:24.26,wD:27.30,(5.5,-.1,;4.73,1.23,;5.2,2.69,;3.96,3.6,;2.71,2.69,;3.19,1.23,;1.38,3.47,;.04,2.69,;-1.29,3.47,;-1.29,5,;.04,5.78,;1.38,5,;2.71,5.78,;-2.62,2.69,;-2.62,1.15,;-3.96,.38,;-5.29,1.15,;-5.29,2.69,;-3.96,3.47,;-3.96,5,;-3.96,-1.15,;-2.42,-1.15,;-5.5,-1.15,;-3.96,-2.69,;-2.62,-3.47,;-1.29,-2.69,;.04,-3.47,;.04,-5,;1.38,-5.78,;2.71,-5,;-1.29,-5.78,;-2.62,-5,)|

BDBM295058

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(7.05,-.65,;6.28,.68,;7.19,1.93,;6.28,3.17,;4.82,2.69,;4.82,1.15,;3.48,3.47,;2.15,2.69,;.82,3.47,;.82,5,;2.15,5.78,;3.48,5,;4.82,5.78,;-.52,2.69,;-.52,1.15,;-1.85,.38,;-3.19,1.15,;-3.19,2.69,;-1.85,3.47,;-1.85,5,;-1.85,-1.15,;-.31,-1.15,;-3.39,-1.15,;-1.85,-2.69,;-3.19,-3.47,;-3.19,-5,;-4.52,-5.78,;-5.85,-5,;-7.19,-5.78,;-5.85,-3.47,;-4.52,-2.69,)|

BDBM295192

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1C[C@H](CO)C1 |r,wU:24.26,wD:26.29,(4.78,-6.84,;4.01,-5.51,;4.48,-4.05,;3.24,-3.14,;1.99,-4.05,;2.47,-5.51,;.66,-3.28,;-.68,-4.05,;-2.01,-3.28,;-2.01,-1.74,;-.68,-.97,;.66,-1.74,;1.99,-.97,;-3.34,-4.05,;-3.34,-5.59,;-4.68,-6.36,;-6.01,-5.59,;-6.01,-4.05,;-4.68,-3.28,;-4.68,-1.74,;-4.68,-7.9,;-6.22,-7.9,;-3.14,-7.9,;-4.68,-9.44,;-3.34,-10.21,;-1.86,-9.81,;-1.46,-11.29,;-.12,-12.06,;1.21,-11.29,;-2.94,-11.69,)|

BDBM295187

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)Nc1cccc(C)n1

BDBM295190

Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(N)(=O)=O

BDBM295177

Cc1oncc1-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O

BDBM50612816

Clc1cc(Nc2cc[nH]n2)nc(OCc2ccncc2)n1

BDBM50612815

Clc1cc(Nc2cc[nH]n2)nc(Oc2ccc(cc2)C#N)n1

BDBM532262

Clc1ccccc1-c1cc(cc(=O)[nH]1)-c1ccnc(Nc2ccccc2)n1

BDBM580165

Clc1ccccc1-c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(cc12)-c1cccnc1

BDBM580164

Clc1ccccc1-c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(cc12)-c1cnco1

BDBM510495

Clc1ccccc1-c1cc(cc(=O)[nH]1)N1CCOCC1

BDBM510497

Cn1c(cc(cc1=O)N1CCOCC1)-c1ccccc1Cl

BDBM527932

Cn1c(cc(cc1=O)N1CCOCC1)N1CCCC1c1ccccc1

BDBM50363167

Cn1c2c(C(C#N)C3(CCNCC3)NC2=O)c2ccc(Cl)c(Cl)c12

BDBM92862

Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1cnc2ccccc2c1

BDBM50597810

Cn1ccc(cc1=O)-c1ccnc(NC(=O)C2CC2)c1

BDBM50488841

Cn1cnc(N)c2ncnc12

BDBM532280

Cn1cnc(Nc2cc(ccn2)-c2cc([nH]c(=O)c2)-c2ccccc2C(F)(F)F)c1

BDBM532275

Cn1nccc1Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1ccccc1C(F)(F)F

BDBM532960

FC(F)(F)C1CCCCN1c1cc(cc(=O)[nH]1)-c1ccnc(NC(=O)C2CC2)c1

BDBM532267

FC(F)(F)C1CCCCN1c1cc(cc(=O)[nH]1)-c1ccnc(Nc2ccccc2)n1

BDBM580174

FC(F)(F)C1CCCCN1c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(cc12)-c1ccc(nc1)C(F)(F)F

BDBM580172

FC(F)(F)C1CCCCN1c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(cc12)-c1cnc(nc1)C(F)(F)F

BDBM580175

FC(F)(F)C1CCCCN1c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(cc12)-c1cncc(c1)C(F)(F)F

BDBM580167

FC(F)(F)C1CCCCN1c1cc(cc(=O)[nH]1)-c1ccnc2[nH]ccc12

BDBM580171

FC(F)(F)C1CCCCN1c1cc(cc(=O)[nH]1)-c1ccnc2[nH]ncc12

BDBM532269

FC(F)(F)C1COCCN1c1cc(cc(=O)[nH]1)-c1ccnc(Nc2ccccc2)n1

BDBM532272

FC(F)(F)C1COCCN1c1cc(cc(=O)[nH]1)-c1ccnc(Nc2ncco2)c1

BDBM580169

FC(F)(F)C1COCCN1c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(cc12)-c1cccc(c1)C(F)(F)F

BDBM580173

FC(F)(F)C1COCCN1c1cc(cc(=O)[nH]1)-c1ccnc2[nH]ccc12

BDBM532976

FC(F)(F)c1ccccc1-c1cc(cc(=O)[nH]1)-c1ccnc(NC(=O)N2CCCC2)c1

BDBM580185

FC(F)(F)c1ccccc1-c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(cc12)C#N

BDBM580183

FC(F)(F)c1ccccc1-c1cc(cc(=O)[nH]1)-c1ccnc2[nH]c(cc12)C1CC1

BDBM580120

FC(F)(F)c1ccccc1-c1cc(cc(=O)[nH]1)-c1ccnc2[nH]ccc12

BDBM580186

FC(F)(F)c1ccccc1-c1cc(cc(=O)[nH]1)-c1ccnc2[nH]ncc12

BDBM50550678

FC(F)CN1CC[C@H](C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|

BDBM50315213

FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1

BDBM50571460

FC1(F)CCN([C@H]1Cc1ccccc1)c1cc(cc(=O)[nH]1)N1CCOCC1 |r|

BDBM338229

FC1(F)CN(C1)C(=O)c1cncc(c1)-c1ccnc(Nc2ccnc(n2)C2CC2)c1

BDBM50597812

FC1CC1C(=O)Nc1cc2cc(ccc2cn1)-c1nncn1-c1ccccc1Cl

BDBM50571461

F[C@@H]1CCN([C@H]1Cc1ccccc1)c1cc(cc(=O)[nH]1)N1CCOCC1 |r|

BDBM50503141

Fc1cc(F)cc(c1)N1[C@@H](CCn2c1nc(cc2=O)N1CCOCC1)C(F)(F)F |r|

BDBM50197064

Fc1ccc(CN2C(=O)COc3ccc(\C=C4/SC(=S)NC4=O)cc23)cc1Cl

BDBM50069761

Fc1ccc(CNc2ncnc3ccc(F)cc23)cc1

BDBM580178

Fc1ccc(CS(=O)(=O)N2CCN(C(C2)C(F)(F)F)c2cc(cc(=O)[nH]2)-c2ccnc3[nH]ccc23)cc1

BDBM50357658

Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)N1CCOCC1

BDBM50357652

Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3cccnc3)c2c1

BDBM50357653

Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3ccncc3)c2c1

BDBM50357645

Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(N3CCOCC3)c2c1

BDBM346236

N(c1ccncn1)c1cc(ccn1)-c1cncc2[nH]ccc12

BDBM338041

NC(=N)NC(=O)c1cc(cnc1N)-c1ccnc(Nc2ccncn2)c1

BDBM50597817

NC(=O)c1ccc2-c3nc(sc3CCOc2c1)-c1ncnn1-c1ccc(F)cc1F

BDBM50597808

NC(=O)c1ccccc1Nc1ccnc(NC(=O)C2CC2)c1

BDBM50612813

NS(=O)(=O)c1ccc(Oc2nc(Cl)cc(Nc3cc[nH]n3)n2)cc1

BDBM50469457

Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2

BDBM50380363

Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F

BDBM50240975

Nc1cc(c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F

BDBM532957

Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1ccccc1Cl

BDBM532956

Nc1cc(ccn1)-c1cc([nH]c(=O)c1)-c1cccnc1

BDBM50341209

Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4cccc(c4)C(F)(F)F)c3c2c1

BDBM50555460

Nc1ccc(cn1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1

BDBM338056

Nc1cncc(c1)-c1ccnc(N)c1

BDBM535569

Nc1nc(c(s1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1)C(F)(F)F |r|

BDBM535712

Nc1nc(c(s1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1)C(F)(F)F

BDBM50240973

Nc1ncc(-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c(n1)C(F)(F)F

BDBM50156294

Nc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccncc2)n1

BDBM352719

Nc1ncc(cc1C(=O)NC12CC(C1)C2)-c1ccnc(Nc2ccncn2)c1

BDBM50555464

Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccn(CCCCCCC(=O)NO)c2n1

BDBM50555462

Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1

BDBM535714

Nc1ncc(s1)-c1cc(Oc2ccccc2)cc(n1)N1CCOCC1

BDBM535559

Nc1ncc(s1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|

BDBM535651

Nc1ncc(s1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1

BDBM50157880

Nc1ncnc2n(cc(-c3cccc(O)c3)c12)[C@@H]1C[C@H](CN2CCC2)C1 |r,wD:17.19,19.22,(-1.03,2.79,;-1.03,1.55,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;3.38,5.56,;1.86,5.34,;1.1,6.31,;1.29,3.91,;.3,.77,;2.24,-2.7,;3.54,-3.45,;2.74,-4.76,;3.1,-6.25,;4.58,-6.69,;5.27,-8.02,;6.62,-7.28,;5.88,-5.93,;1.42,-3.96,)|

BDBM50157881

Nc1ncnc2n(cc(-c3cccc(OC[C@@H]4CCCO4)c3)c12)[C@@H]1C[C@H](CN2CCC2)C1 |r,wD:23.26,16.15,25.29,(-1.03,2.79,;-1.03,1.55,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;3.38,5.55,;1.86,5.34,;.91,6.55,;1.49,7.98,;.54,9.2,;-.98,9.12,;-1.51,10.57,;-.3,11.52,;.98,10.66,;1.29,3.91,;.3,.77,;2.24,-2.7,;3.54,-3.45,;2.74,-4.76,;3.1,-6.25,;4.58,-6.69,;5.27,-8.02,;6.62,-7.28,;5.88,-5.93,;1.42,-3.96,)|

BDBM535594

Nc1nnc(s1)-c1cc(N)cc(c1)S(=O)(=O)c1ccccc1

BDBM535614

Nc1nsc(n1)-c1cc(N)cc(c1)S(=O)(=O)c1ccccc1

BDBM346213

O=C(Cc1nnn[nH]1)Nc1cc(ccn1)-c1cncc2n(ccc12)S(=O)(=O)C1CC1

BDBM50597807

O=C(Nc1cc(ccn1)-c1ccn2ccnc2c1)C1CC1

BDBM337941

O=C(Nc1cc(ccn1)-c1cnc2[nH]ncc2c1)C1CC1

BDBM50597809

O=C(Nc1cc(ccn1)-n1cnc2ccccc12)C1CC1

BDBM346235

O=S(=O)(C1CC1)n1ccc2c(cncc12)-c1ccnc(Nc2ccncn2)c1

BDBM346201

O=S(=O)(c1ccccc1)n1ccc2c(cncc12)-c1ccnc(Nc2ncco2)c1

BDBM532263

O=c1cc(cc([nH]1)-c1cccnc1)-c1ccnc(Nc2ccccc2)n1

BDBM532264

O=c1cc(cc([nH]1)-c1ccncc1)-c1ccnc(Nc2ccccc2)n1

BDBM50571454

O=c1cc(cc([nH]1)N1CCCC1Cc1ccccc1)N1CCOCC1

BDBM580121

O=c1cc(cc([nH]1)N1CCCC1c1ccccc1)-c1ccnc2[nH]ccc12

BDBM527931

O=c1cc(cc([nH]1)N1CCCC1c1ccccc1)N1CCOCC1

BDBM50571459

O=c1cc(cc([nH]1)N1CCCCC[C@@H]1Cc1ccccc1)N1CCOCC1 |r|

BDBM50571458

O=c1cc(cc([nH]1)N1CCCC[C@@H]1Cc1ccccc1)N1CCOCC1 |r|

BDBM50571455

O=c1cc(cc([nH]1)N1CCC[C@@H]1Cc1ccccc1)N1CCOCC1 |r|

BDBM527934

O=c1cc(cc([nH]1)N1CCC[C@@H]1c1ccccc1)N1CCOCC1 |r|

BDBM50571456

O=c1cc(cc([nH]1)N1CCC[C@H]1Cc1ccccc1)N1CCOCC1 |r|

BDBM527933

O=c1cc(cc([nH]1)N1CCC[C@H]1c1ccccc1)N1CCOCC1 |r|

BDBM532265

O=c1cc(cc([nH]1)N1CCOCC1)-c1ccnc(Nc2ccccc2)n1

BDBM50571467

O=c1cc(nc([nH]1)N1CCCCC[C@@H]1Cc1ccccc1)N1CCOCC1 |r|

BDBM50550686

O=c1cc(oc(c1)-c1cccc2Cc3cc(OC4COC4)ccc3Sc12)N1CCOCC1

BDBM50555461

OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1

BDBM50503135

O[C@@H](CN1[C@@H](CCn2c1nc(cc2=O)N1CCOCC1)C(F)(F)F)c1ccccc1 |r|

BDBM50503142

O[C@H](CN1[C@@H](CCn2c1nc(cc2=O)N1CCOCC1)C(F)(F)F)c1ccccc1 |r|

BDBM185152

Oc1cc(ccc1F)-n1c2c3cc[nH]c3ncc2ccc1=O

BDBM50571466

Oc1cc(nc(n1)N1CCC[C@@H]1Cc1ccccc1)N1CCOCC1 |r|

BDBM50571465

Oc1cc(nc(n1)N1CCOCC1)N1CCC[C@@H]1Cc1ccccc1 |r|

BDBM50197065

Oc1cccc(c1)-c1cc2c3cccnc3oc2c(n1)N1CCOCC1

BDBM50612805

[H][C@@]12CCC(=O)[C@@]1(C)C=Cc1c(C)c3c(coc3c(O)c21)C(=O)OC |c:9|

BDBM50612803

[H][C@@]12CCC(=O)[C@@]1(C)CC=C1C2C(=O)c2occ3c2[C@]1(C)[C@@H](COC)OC3=O |c:10|

BDBM50612804

[H][C@@]12CCC(=O)[C@@]1(C)CCC1=C2C(=O)c2occ3c2[C@]1(C)[C@@H](COC)OC3=O |c:11|

BDBM50612795

[H][C@@]12CCC(=O)[C@@]1(C)C[C@@H](OC(C)=O)C1=C2C(=O)C(O)=C2\C(=C\N(CC)CC)C(=O)O[C@H](COC)[C@]12C |c:15,t:21|

BDBM50612796

[H][C@@]12CCC(=O)[C@@]1(C)C[C@@H](OC(C)=O)C1=C2C(=O)C(O)=C2\C(=C\NCCCC)C(=O)O[C@H](COC)[C@]12C |r,c:15,t:21|

BDBM50612797

[H][C@@]12CCC(=O)[C@@]1(C)C[C@@H](OC(C)=O)C1=C2C(=O)C2=C3C(=CCO2)C(=O)O[C@H](COC)[C@]13C |c:15,22,t:20|

BDBM15234

[H][C@@]12CCC(=O)[C@@]1(C)C[C@@H](OC(C)=O)C1=C2C(=O)c2occ3c2[C@]1(C)[C@@H](COC)OC3=O |r,c:15|

BDBM50612798

[H][C@@]12CCC(OC(C)=O)[C@@]1(C)C[C@@H](OC(C)=O)C1=C2C(=O)c2occ3c2[C@]1(C)[C@@H](COC)OC3=O |r,c:18|

BDBM50612802

[H][C@@]12CC[C@H](O)[C@@]1(C)C[C@@H](OC(C)=O)C1=C2C(=O)c2occ3c2[C@]1(C)[C@@H](COC)OC3=O |c:15|

BDBM50612799

[H][C@@]12C[C@@H](Br)C(OC(C)=O)[C@@]1(C)C[C@@H](OC(C)=O)C1=C2C(=O)c2occ3c2[C@]1(C)[C@@H](COC)OC3=O |r,c:19|

BDBM50612800

[H][C@@]12C[C@@H](O)C(OC(C)=O)[C@@]1(C)C[C@@H](OC(C)=O)C1=C2C(=O)c2occ3c2[C@]1(C)[C@@H](COC)OC3=O |r,c:19|

BDBM50612801

[H][C@@]12C[C@@H](OC(C)=O)C(OC(C)=O)[C@@]1(C)C[C@@H](OC(C)=O)C1=C2C(=O)c2occ3c2[C@]1(C)[C@@H](COC)OC3=O |r,c:22|

BDBM50571463

[H][C@@]12C[C@]1([H])[C@H](Cc1ccccc1)N(C2)c1cc(cc(=O)[nH]1)N1CCOCC1 |r|

BDBM50571473

[H][C@@]12C[C@]1([H])[C@H](Cc1ccccc1)N(C2)c1cc(cc(=O)[nH]1)N1CCO[C@H](C)C1 |r|

BDBM50571474

[H][C@@]12C[C@]1([H])[C@H](Cc1ccccc1)N(C2)c1nc(cc(=O)[nH]1)N1CCOCC1 |r|

BDBM50571475

[H][C@@]12C[C@]1([H])[C@H](Cc1ccccc1)N(C2)c1nc(cc(=O)[nH]1)N1CCO[C@H](C)C1 |r|

BDBM50607957

[H][C@]1(CSCN1c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1cccs1 |r|

BDBM50607955

[H][C@]1(CSCN1c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1ccnn1C |r,wU:1.0,(2.02,2.17,;2.02,.63,;3.36,1.4,;4.51,.33,;3.89,-1.04,;2.36,-.86,;1.27,-1.95,;-.23,-1.55,;-1.31,-2.65,;-.91,-4.13,;.58,-4.53,;.98,-6.01,;1.67,-3.44,;3.15,-3.84,;4.64,-4.24,;.69,1.4,;-.64,.62,;-1.98,1.4,;-3.3,.63,;-4.64,1.39,;-4.64,2.94,;-3.31,3.7,;-3.31,5.24,;-1.98,2.94,;-.65,3.7,;-.65,5.24,;.69,2.93,;2.02,3.7,;3.48,3.24,;4.4,4.49,;3.52,5.71,;2.02,5.24,;.69,6.01,)|

BDBM50607954

[H][C@]1(CSCN1c1ncnc2[nH]cnc12)c1nc2cccc(Cl)c2c(=O)n1-c1ccnn1C |r,wU:1.0,(2.09,2.1,;2.09,.56,;3.42,1.33,;4.58,.27,;3.96,-1.1,;2.42,-.93,;1.33,-2.02,;-.16,-1.62,;-1.24,-2.71,;-.84,-4.19,;.64,-4.59,;1.35,-5.95,;2.87,-5.72,;3.12,-4.24,;1.73,-3.51,;.75,1.33,;-.57,.56,;-1.91,1.33,;-3.24,.56,;-4.58,1.32,;-4.58,2.87,;-3.24,3.64,;-3.24,5.18,;-1.91,2.87,;-.58,3.64,;-.58,5.18,;.75,2.87,;2.08,3.64,;3.55,3.18,;4.46,4.42,;3.59,5.64,;2.08,5.18,;.75,5.95,)|

BDBM50571464

[H][C@]12C[C@@]1([H])[C@H](Cc1ccccc1)N(C2)c1cc(cc(=O)[nH]1)N1CCOCC1 |r|

BDBM50571470

[H][C@]12C[C@@]1([H])[C@H](Cc1ccccc1)N(C2)c1cc(cc(=O)[nH]1)N1CCO[C@H](C)C1 |r|

BDBM50571471

[H][C@]12C[C@@]1([H])[C@H](Cc1ccccc1)N(C2)c1nc(cc(=O)[nH]1)N1CCOCC1 |r|

BDBM50571472

[H][C@]12C[C@@]1([H])[C@H](Cc1ccccc1)N(C2)c1nc(cc(=O)[nH]1)N1CCO[C@H](C)C1 |r|

BDBM50505414

[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3ccc(N)nc3)N1CCOC2 |r|

BDBM50505410

[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)cn3)N1CCOC2 |r|

BDBM50505407

[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)nc3)N1CCOC2 |r|

BDBM50612812

[O-][N+](=O)c1ccc(Oc2nc(Cl)cc(Nc3cc([nH]n3)C3CC3)n2)cc1

BDBM50537996

c1nn2cccnc2c1-c1nc2ccccc2s1