SMILES for 5-hydroxytryptamine receptor 1E

COc1cc(N)c(Cl)cc1C(=O)NC1CN2CCC1CC2 |(27.19,-33.96,;28.52,-34.73,;28.53,-36.27,;27.2,-37.04,;27.2,-38.58,;25.86,-39.35,;28.53,-39.36,;28.53,-40.89,;29.87,-38.58,;29.86,-37.03,;31.19,-36.26,;31.19,-34.72,;32.53,-37.02,;33.86,-36.25,;35.2,-37.02,;36.52,-36.25,;36.52,-34.71,;35.19,-33.94,;33.85,-34.71,;34.61,-36.04,;35.74,-34.91,)|

BDBM50005257

COc1cc(CC(C)N)c(OC)cc1Br

BDBM50007871

CN1C2CCC1CC(C2)OC(=O)c1c[nH]c2ccccc12 |THB:9:7:1:3.4|

BDBM82505

CCCCN1CCC(COC(=O)c2cc(Cl)c(N)c3OCCOc23)CC1

BDBM50007407

C1CN(CCN1)c1cccc2ccccc12

BDBM30704

CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@H]2[C@H]1Cc1cn(C)c3cccc2c13

BDBM82472

CC(N)Cc1c[nH]c2ccc(OCc3cccs3)cc12

BDBM84991

Cc1cc(NC(=O)Nc2ccc3n(C)ccc3c2)sn1

BDBM50060417

Cn1ccc2cc3N(CCc3cc12)C(=O)Nc1cccnc1

BDBM50252513

Cc1nc2C(O)CCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12

BDBM22869

CN1CCN(CC1)C1=c2ccccc2=Nc2ccc(Cl)cc2N1 |c:8,15|

BDBM26948

Fc1ccc(cc1)C(CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccc(F)cc1

BDBM21398

c1cc(ccc1C(=O)CCCN2CCC(CC2)(c3ccc(cc3)Cl)O)F

BDBM82479

CN1CCN(CC1)C1=c2cc(C)sc2=Nc2ccccc2N1 |c:8,15|

BDBM84994

CN1CC2C(C1)c1cc(Cl)ccc1Oc1ccccc21

BDBM81483

NC(=O)C1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)N1CCCCC1

BDBM50095890

OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2ccccc12 |t:13|

BDBM50001885

CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)c4c5ccc(cc5on4)F

BDBM50001786

Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Cl)ccc12

BDBM50048803

c1ccc2c(c1)c(ns2)N3CCN(CC3)CCc4cc5c(cc4Cl)NC(=O)C5

BDBM35255

CN(C)CCOC1=Cc2ccccc2Sc3c1cc(cc3)Cl

BDBM85165

OC(CN1CCN(CC1)c1cccc(Cl)c1)C(c1ccccc1)c1ccccc1

BDBM79215

COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1N1CCN(C)CC1

BDBM85166

COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1OCCN(C)C

BDBM85195

CN(C)C1CCc2[nH]c3ccc(NC(=O)c4ccc(F)cc4)cc3c2C1

BDBM50098550

C[C@H](CCN1CCC(C)CC1)N(C)S(=O)(=O)c1cccc(C)c1

BDBM50084959

CN1CCC2(COc3cc4CCN(C(=O)c5ccc(cc5)-c5ccc(cc5C)-c5noc(C)n5)c4cc23)CC1

BDBM50003359

CCCCCCOc1c(nsn1)C2=CCCN(C2)C

BDBM85608

CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1

BDBM85610

CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(Br)c2)CC1

BDBM50130278

CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc3ccccc23)CC1

BDBM85612

CC1CCN(CC[C@H]2CCCCC2S(=O)(=O)c2cccc3ccccc23)CC1

BDBM50130279

CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(C)c2)CC1

BDBM85613

CC1CCN(CCC2CCCCC2S(=O)(=O)c2cccc3ccccc23)CC1

BDBM50098551

CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1 |r|

BDBM50167898

O=C(NC1CC[C@H](CCN2CCc3cc(ccc3C2)C#N)CC1)c1ccnc2ccccc12 |wD:6.6,(-3.87,-1.76,;-3.86,-3.3,;-2.52,-4.08,;-1.18,-3.3,;-1.19,-1.76,;.15,-.99,;1.48,-1.76,;2.83,-.99,;4.16,-1.76,;5.49,-.99,;5.49,.54,;6.84,1.31,;8.17,.53,;9.5,1.3,;10.83,.53,;10.81,-1.01,;9.48,-1.78,;8.16,-1.01,;6.84,-1.78,;12.17,1.29,;13.5,2.07,;1.48,-3.3,;.15,-4.08,;-5.19,-4.09,;-5.19,-5.64,;-6.54,-6.41,;-7.87,-5.64,;-7.87,-4.09,;-9.19,-3.33,;-9.2,-1.81,;-7.87,-1.03,;-6.54,-1.78,;-6.54,-3.33,)|

BDBM50122872

COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(N)c2CCOc12

BDBM85818

CC(CF)NCC(O)COc1cccc2[nH]c3ccccc3c12

BDBM84745

CNCC[C@@H](c1cccs1)Oc2cccc3c2cccc3

BDBM82071

COc1ccc(cc1)C(CN(C)C)C1(O)CCCCC1

BDBM50159165

COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1 |r|

BDBM50010588

C[C@@H](Cc1ccc2c(c1)OCO2)NC

BDBM50130293

c1cc(c(c(c1)Cl)Cl)N2CCN(CC2)CCCCOc3ccc4c(c3)NC(=O)CC4

BDBM50232153

COc1cccc(C(O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC

BDBM26739

NC(=O)c1cccc(c1)-c1cccc(OC(=O)NC2CCCCC2)c1

BDBM86708

COc1ccccc1N1CCN(CCN(C(=O)C2CCCCC2)c2ccccn2)CC1

BDBM86757

COc1ccccc1N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1

BDBM81790

CCN1CCCC1CNC(=O)c1cc(c(N)cc1OC)S(=O)(=O)CC

BDBM50081701

CN(C)CCc1c[nH]c2c1c(ccc2)O

BDBM601697

COc1cc(c(OC)cc1C1CCCNC1)C(F)(F)F

BDBM50005247

CC(N)Cc1ccc2OCOc2c1

BDBM707600

CNC(C)Cc1ccc2c(c1)OCO2

BDBM50059891

COc1cc(cc(c1OC)OC)CCN

BDBM50005267

COc1cc(CCN)c(OC)cc1Br

BDBM50026868

CN(C)CCc1c[nH]c2c1cccc2

BDBM50240788

CCc1cc(OC)c(CCN)cc1OC

BDBM707484

CCSc1cc(OC)c(CCN)cc1OC

BDBM50164337

CCSc1cc(OC)c(CC(C)N)cc1OC

BDBM50005255

CCOc1cc(OC)c(CC(C)N)cc1OC

BDBM707610

COc1ccc2[nH]cc(CCN(C)C(C)C)c2c1

BDBM707611

CC(C)N(CCc1c[nH]c2ccccc12)C(C)C

BDBM707612

COc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1

BDBM707613

CCCN(CCC)CCc1c[nH]c2ccccc12

BDBM50164331

CCSc1cc(OC)c(CC(N)CC)cc1OC

BDBM707615

CN(C)CCc1c[nH]c2cc(F)ccc12

BDBM50056445

CCN(CC)C(=O)N[C@@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)C

BDBM81783

BDBM50052339

NCCc1c2CCOc2c(Br)c2CCOc12

BDBM50005265

COc1cc(CC(C)N)c(OC)cc1C

BDBM50005256

COc1cc(CC(C)N)cc(OC)c1OC

BDBM81965

CCc1cc(OC)c(CC(C)N)cc1OC

BDBM50005253

COc1cc(OC)c(OC)cc1CC(C)N

BDBM50241702

CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)C

BDBM707624

C[C@@H]1C[C@H](C)N1C(=O)C1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1

BDBM707625

C[C@@H]1C[C@@H](C)N1C(=O)C1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1

BDBM707626

C[C@@H]1C[C@@H](C)N1C(=O)C1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1

BDBM50085972

COc1ccc2[nH]c(C)c(CCN(C)C)c2c1

BDBM34142

CCc1[nH]c2ccc(OC)cc2c1CCN(C)C

BDBM50014945

CC(N)Cc1c[nH]c2ccc(O)cc12

BDBM50014946

COc1ccc2[nH]c(C)c(CCN)c2c1

BDBM50060437

Fc1cccc(CCN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)c1

BDBM50060429

OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(F)cc1

BDBM50085970

COc1ccc2[nH]c(c(CCN(C)C)c2c1)-c1ccccc1

BDBM34141

COc1ccc2n(cc(CCN(C)C)c2c1)S(=O)(=O)c1ccccc1

BDBM50099892

CSc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1

BDBM50099889

C=Cc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1

BDBM50099888

CCc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1

BDBM50099891

FC(F)(F)c1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1

BDBM50099890

COc1ccccc1N1CCN(Cc2c[nH]c3ncccc23)CC1

BDBM50099887

Fc1ccccc1N1CCN(Cc2c[nH]c3ncccc23)CC1

BDBM50099894

CCCc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1

BDBM50099895

C(N1CCN(CC1)c1ccc(cc1)-c1ccccc1)c1c[nH]c2ncccc12

BDBM50075360

COc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1

BDBM85093

c1cc2c(c[nH]c2nc1)CN3CCN(CC3)c4ccc(cc4)Cl

BDBM50099893

Fc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1

BDBM50130426

CCC(=O)Nc1ccc2[nH]cc(C3CCN(C)CC3)c2n1

BDBM50130443

CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)nc12

BDBM50132341

COc1cc2CCN(C)C3Cc4cc5OCOc5cc4-c(c1OCc1ccc(Br)cc1)c23

BDBM50182020

COc1cccc(c1)N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1

BDBM50215552

FCc1nc(cs1)C#Cc1cc(F)cc(c1)C#N

BDBM50240412

NC(=O)c1ccc2[nH]cc(C3=CCC(CC3)NCCCCCCCNC3CCC(=CC3)c3c[nH]c4ccc(cc34)C(N)=O)c2c1 |c:29,t:10|

BDBM50252659

Clc1ccc(cc1Cl)C(=O)N[C@H]1CCN(Cc2ccc(OC3CCNCC3)c(Br)c2)C1 |r|

BDBM50435344

COc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1

BDBM50140053

Fc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1

BDBM50140054

Clc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1

BDBM50140058

C=CCN(CCc1c[nH]c2ccccc12)CC=C

BDBM50140055

Brc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1

BDBM50140056

Cc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1

BDBM50232152

COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(F)cc2)CC1

BDBM50267507

COc1c(OCCF)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 |r|

BDBM50267508

COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1

BDBM50267509

COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(cc2)[N+]([O-])=O)CC1

BDBM50267510

COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(C)cc2)CC1

BDBM50267554

COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(C)cc2)CC1

BDBM50267555

COc1ccc(CCN2CCC(CC2)C(O)c2cccc(OCCF)c2OC)cc1

BDBM50267556

COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(cc2)[N+]([O-])=O)CC1

BDBM50267557

COc1ccc(CCN2CCC(CC2)C(=O)c2cccc(OCCF)c2OC)cc1

BDBM50378386

CC1(C)NC(Nc2cccc(Br)c2)=NC(N)=N1 |c:13,16|

BDBM50148833

CCOC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 |c:14,t:11|

BDBM50148830

CCOC(=O)c1cccc(NC2=NC(=NC3(CCCCC3)N2)N(C)C)c1 |c:13,t:11|

BDBM50148831

NC1=NC2(CCCCC2)NC(Nc2cccc(Br)c2)=N1 |c:20,t:1|

BDBM50148832

CCNC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 |c:14,t:11|

BDBM50285315

NC(=O)c1ccc2[nH]cc(C3=CCC(CC3)NCCNC3CCC(=CC3)c3c[nH]c4ccc(cc34)C(N)=O)c2c1 |c:24,t:10|

BDBM50285314

NC(=O)c1ccc2[nH]cc(C3=CCC(CC3)NCCCCCCCCNC3CCC(=CC3)c3c[nH]c4ccc(cc34)C(N)=O)c2c1 |c:30,t:10|

BDBM50285317

NC(=O)c1ccc2[nH]cc(C3=CCC(CC3)NCCCNC3CCC(=CC3)c3c[nH]c4ccc(cc34)C(N)=O)c2c1 |c:25,t:10|

BDBM50285312

NC(=O)c1ccc2[nH]cc(C3=CCC(CC3)NCCCCNC3CCC(=CC3)c3c[nH]c4ccc(cc34)C(N)=O)c2c1 |c:26,t:10|

BDBM50285313

NC(=O)c1ccc2[nH]cc(C3=CCC(CC3)NCCCCCCCCCCNC3CCC(=CC3)c3c[nH]c4ccc(cc34)C(N)=O)c2c1 |c:32,t:10|

BDBM50285316

NC(=O)c1ccc2[nH]cc(C3=CCC(CC3)NCCCCCCNC3CCC(=CC3)c3c[nH]c4ccc(cc34)C(N)=O)c2c1 |c:28,t:10|

BDBM50285318

NC(=O)c1ccc2[nH]cc(C3=CCC(CC3)NCCCCCNC3CCC(=CC3)c3c[nH]c4ccc(cc34)C(N)=O)c2c1 |c:27,t:10|

BDBM50204306

[H][C@@]12CCC[C@@]3([H])N(CCC)CC[C@@]([H])(c4cc5ccc(cc5nc4[C@@H]1CC)C(F)(F)F)[C@]23[H] |r|

BDBM50204312

[H][C@]12CCN(C)[C@]3([H])CCC[C@]([H])([C@@H](Cc4ccccc4)C(=O)C1)[C@@]23[H] |r|

BDBM50207400

CC(=O)c1ccc(OCc2ccc(Oc3cc(ccn3)-c3nn[nH]n3)cc2)c(C)c1O

BDBM50304075

CN(C)Cc1nc(-c2ccc(cc2)C(C)(C)C)n(n1)-c1cccc(O)c1

BDBM50103142

Oc1ccc2[nH]cc([C@H]3C[C@@H]4CC[C@H](C3)N4C[C@H]3CC[C@H](CC3)NC(=O)\C=C\c3ccc(Cl)c(Cl)c3)c2c1 |wU:10.16,8.7,20.25,17.18,13.15,THB:16:15:8.14.9:11.12,(1.43,-5.64,;2.76,-6.41,;2.76,-7.94,;4.09,-8.72,;5.49,-7.93,;6.98,-8.35,;7.82,-7.06,;6.89,-5.85,;7.28,-4.38,;6.21,-3.29,;6.63,-1.8,;7.03,-3.29,;8.1,-3.61,;9.19,-2.54,;8.77,-4.01,;8.12,-1.42,;7.05,-.12,;7.66,1.49,;6.75,2.73,;7.35,4.13,;8.89,4.31,;9.82,3.08,;9.19,1.66,;9.5,5.75,;10.97,6.18,;11.33,7.68,;12.09,5.13,;13.55,5.54,;14.67,4.49,;14.01,3.1,;14.88,1.83,;16.42,1.95,;17.28,.67,;17.1,3.35,;18.64,3.44,;16.24,4.61,;5.44,-6.39,;4.09,-5.62,)|

BDBM50091438

Oc1ccc2[nH]cc(C3CCN(CCCCCNC(=O)\C=C\c4ccc(Cl)c(Cl)c4)CC3)c2c1

BDBM50130286

COc1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)cc1N1CCN(C)CC1

BDBM28583

COc1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)cc1N1CCNCC1

BDBM50001824

[H][C@]12CCCN1CCN(C2)c1cc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)ccc1OC

BDBM50219439

COc1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)cc1N1CCN2CCCCC2C1

BDBM50130270

COc1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)cc1N1CCN2CCC[C@H]2C1

BDBM50130261

Clc1ccc(OC2CCN(CC[C@H]3CCCN3S(=O)(=O)c3ccc4cc[nH]c4c3)CC2)cc1

BDBM50125260

Fc1ccc2n(C3CCN(CCN4CCCc5ccccc5C4=O)CC3)c(=O)[nH]c2c1

BDBM50326197

Cn1c2nc(=O)n(C)c(N)c2[nH]c1=O

BDBM50327861

CCCCN1CCC(COC(=O)c2ccc(N)c(OC)c2)CC1

BDBM50327860

CCCCN1CCC(COC(=O)c2cc(Cl)c(NC)c3OCCOc23)CC1

BDBM50327863

CCCCN1CCC(COC(=O)c2cc(F)c(N)c3OCCOc23)CC1

BDBM50106482

CN(C)CCc1c(C)[nH]c2cccc(NC(=O)c3ccc(F)cc3)c12

BDBM50118576

C[C@H]1C[C@@H](C)N1C(=O)[C@H]1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34 |c:24|

BDBM50118579

C[C@H]1C[C@H](C)N1C(=O)[C@H]1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34 |c:24|

BDBM50118577

C[C@@H]1C[C@@H](C)N1C(=O)[C@H]1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34 |c:24|

BDBM21342

CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)C

BDBM50449038

c1cc(cc(c1)Cl)CCNCCc2ccc3ccc(nc3c2)N

BDBM50271706

COc1ccccc1CNCCc1cc(OC)c(I)cc1OC

BDBM50160160

COc1cc2CCN(C)[C@H]3Cc4cc5OCOc5cc4-c(c1OC)c23

BDBM50336843

Fc1nc(cs1)C#Cc1cc(F)cc(c1)C#N

BDBM50158610

C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(F)cc1

BDBM50383117

C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(cc1)[N+]([O-])=O |r|

BDBM50399622

CCCN1CCC(COc2nc3c(I)cccc3c3ncccc23)CC1

BDBM50399623

CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1

BDBM50399614

CCCN1CCC(COc2nc3c(F)cccc3c3ncccc23)CC1

BDBM50399615

CCCN1CCC(COc2nc3ccccc3c3ncccc23)CC1

BDBM50399619

CCCN1CCC(COc2nc3c(F)cccc3c3ccccc23)CC1

BDBM50399616

CCCN1CCC(COc2nc3c(Cl)cccc3c3ccccc23)CC1

BDBM50399620

CCCN1CCC(COc2nc3c(OC)cccc3c3ccccc23)CC1

BDBM50403827

COc1ccc(cc1N1CCNCC1)S(=O)(=O)N1CCc2ccc(I)cc12

BDBM50130268

COc1ccc(cc1N1CCNCC1)S(=O)(=O)Nc1cc(Br)cc(F)c1Br

BDBM50403833

COc1ccc(cc1N1CCNCC1)S(=O)(=O)Nc1cc(Cl)cc(Cl)c1Cl

BDBM50403826

COc1ccc(cc1N1CCNCC1)S(=O)(=O)Nc1cc(Br)ccc1Br

BDBM50412131

Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)N4CCCS4(=O)=O)CC3)cccc2n1

BDBM50412132

Cc1ccc2c(OCCN3CCC(Cc4cccc(NS(C)(=O)=O)c4)CC3)cccc2n1

BDBM50458550

Fc1ccc(cc1)-c1n[nH]c2CCNCCc12

BDBM50458555

Clc1ccc(cc1)-c1n[nH]c2CCNCCc12

BDBM50458558

Cc1ccc(cc1)-c1n[nH]c2CCNCCc12

BDBM50458557

Cc1ccc(cc1)-c1noc2CCNCCc12

BDBM50458553

Fc1ccc(cc1)-c1noc2CCNCCc12

BDBM50458554

Clc1ccc(cc1)-c1noc2CCNCCc12

BDBM50370517

CN1CCN(CC1)c1ccc2CN(Cc2c1)C(=O)OCc1ccccc1

BDBM50370625

CC(=C)CN1CCN(CC1)c1ccc2CCN(Cc2c1)C(=O)OCc1ccccc1

BDBM50370627

CCOC(=O)CCN1CCN(CC1)c1ccc2CCN(Cc2c1)C(=O)OCc1ccccc1

BDBM50335600

NC(=O)C1CSC(=N1)c1ccccc1O |c:6|

BDBM50456730

C[C@@H]1SC(=N[C@H]1CO)c1ccco1 |r,c:3|

BDBM50456724

COC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1N=C(S[C@@H]1C)c1ccccc1O |r,c:16|

BDBM50335603

C[C@@H]1SC(=N[C@@H]1CO)c1ccccc1O |r,c:3|

BDBM50456737

COC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H]1N=C(S[C@@H]1C)c1ccccc1O |r,c:16|

BDBM50456740

Oc1ccccc1C1=NC(Cc2c[nH]cn2)CS1 |t:8|

BDBM50456727

Oc1ccccc1C1=NC(Cc2c[nH]cn2)C(S1)c1ccccc1 |t:8|

BDBM50456733

CNc1ccccc1C1=N[C@@H](CO)[C@H](C)S1 |r,t:9|

BDBM50456736

C[C@@H]1SC(=N[C@H]1CO)c1cc2ccccc2cc1O |r,c:3|

BDBM50456729

C[C@@H]1SC(=N[C@H]1CO)c1c[nH]c2ccccc12 |r,c:3|

BDBM50456732

CCCCCCOc1ccc(cc1)C1=N[C@@H](CO)[C@H](C)S1 |r,t:14|

BDBM50456725

CCCCCCCCOc1ccc(cc1)C1=N[C@@H](CO)[C@H](C)S1 |r,t:16|

BDBM50456741

C[C@@H]1SC(=N[C@@H]1Cc1c[nH]cn1)c1ccccc1 |r,c:3|

BDBM50335598

OC[C@@H]1CSC(=N1)c1ccccc1O |r,c:5|

BDBM50456744

Oc1ccccc1-c1nc(C=O)cs1

BDBM50335601

C[C@@H]1SC(=N[C@H]1[C@@H]1SC[C@@](C)(N1C)C(O)=O)c1ccccc1O |r,c:3|

BDBM50456726

C[C@H]1SC(=N[C@@H]1CO)c1ccccc1O |r,c:3|

BDBM50456745

C[C@@H]1SC(=N[C@H]1CO)c1ccccc1O |r,c:3|

BDBM50456723

[H][C@]12CCC[C@@]1([H])N=C(S2)c1ccccc1O |r,c:8|

BDBM50335599

NC(=O)c1csc(n1)-c1ccccc1O

BDBM50456743

C[C@H]1SC(=N[C@H]1CO)c1ccccc1O |r,c:3|

BDBM50456738

C[C@@H]1SC(=N[C@H]1CO)c1cccs1 |r,c:3|

BDBM50335602

C[C@@H]1SC(=N[C@H]1[C@H]1SC[C@@](C)(N1C)C(O)=O)c1ccccc1O |r,c:3|

BDBM50456728

CCCCOc1ccc(cc1)C1=N[C@@H](CO)[C@H](C)S1 |r,t:12|

BDBM50456734

C[C@@H]1SC(=N[C@H]1Cc1c[nH]cn1)c1ccccc1O |r,c:3|

BDBM50456731

C[C@@H]1SC(=N[C@H]1CO)c1ccccc1 |r,c:3|

BDBM50456722

C[C@@H]1SC(=N[C@H]1CO)c1ccsc1 |r,c:3|

BDBM50456735

C[C@@H]1SC(=N[C@H]1Cc1c[nH]cn1)c1ccccc1 |r,c:3|

BDBM50474942

CN(C)CCN(Cc1ccc(cc1)-c1ccc(CNCCc2ccccc2)cc1)C(=O)C=Cc1ccccc1

BDBM50474935

O=C(C=Cc1ccccc1)N(Cc1ccc(cc1)-c1ccc(CNCCc2ccccc2)cc1)Cc1cccnc1

BDBM50474937

CN(C)CCN(Cc1ccc(cc1)-c1ccc(CNCCc2ccccc2)cc1)C(=O)CCC1CCCC1

BDBM50412120

Cc1ccc2c(OCCN3CCN(Cc4cccc5cccnc45)CC3)cccc2n1

BDBM50483172

COC(=O)CCCCCN1CCC(CNC(=O)c2c3OCCCn3c3ccccc23)CC1

BDBM50483176

OC(=O)CCCCCN1CCC(CNC(=O)c2c3OCCCn3c3ccccc23)CC1

BDBM50503048

[H][C@@]12CCN[C@]1(C)CN(c1ccccc1)c1ccccc21 |r|

BDBM50503047

CC[C@H]1c2cc(OC)ccc2CC[C@@]1(C)N |r|

BDBM50503043

CC[C@H]1c2cc(C)ccc2OC[C@@]1(C)N |r|

BDBM50503049

[H][C@@]12CCN[C@]1(C)COc1cc(OC)cc(OC)c21 |r|

BDBM50503044

CC[C@H]1c2ccccc2N(C[C@@]1(C)N)c1ccccc1 |r|

BDBM50523440

Cc1ncc2nccn2c1-c1ccc(Oc2nccc3occc23)cc1C(F)(F)F |(17.28,-55.18,;17.28,-53.64,;18.61,-52.87,;18.61,-51.33,;17.26,-50.56,;16.94,-49.07,;15.41,-48.91,;14.79,-50.31,;15.93,-51.33,;15.95,-52.87,;14.62,-53.65,;14.63,-55.19,;13.29,-55.96,;11.96,-55.19,;10.63,-55.96,;10.64,-57.5,;11.97,-58.26,;11.98,-59.81,;10.64,-60.59,;9.31,-59.81,;7.83,-60.29,;6.93,-59.04,;7.84,-57.79,;9.31,-58.27,;11.95,-53.66,;13.28,-52.88,;13.27,-51.34,;11.93,-50.58,;14.38,-50.56,;13.26,-49.79,)|

BDBM50523438

FC(F)(F)c1cc(Oc2nccc3occc23)ccc1-c1cccc2nccn12

BDBM50523439

FC(F)(F)c1cc(Oc2nccc3ccsc23)ccc1-c1cccc2nccn12

BDBM50465935

Cc1cc(Oc2nccc3occc23)ccc1-c1c(C)ncc2nccn12 |(29.98,-5.28,;29.99,-6.82,;28.67,-7.59,;28.68,-9.13,;27.35,-9.9,;27.36,-11.44,;28.69,-12.2,;28.7,-13.75,;27.36,-14.52,;26.03,-13.75,;24.57,-14.23,;23.66,-13,;24.55,-11.74,;26.02,-12.21,;30.02,-9.9,;31.35,-9.12,;31.34,-7.58,;32.66,-6.8,;34,-7.57,;34.01,-9.11,;35.33,-6.79,;35.32,-5.25,;33.97,-4.49,;33.64,-2.99,;32.12,-2.84,;31.5,-4.24,;32.64,-5.27,)|

BDBM50116766

CCCN[C@H]1CCc2c(sc(n2)N)C1

BDBM50539742

Cc1nccc2-c3ccc(Br)cc3NC(C)(C)c12

BDBM50541998

CC(=O)N1CCC(CC1)c1ccc(cc1)-c1cc(cc2cc(ccc12)-c1ccc(cc1)C(F)(F)F)C(O)=O

BDBM50573233

Cc1cccc(c1)-c1n[nH]cc1N1CCCNCC1

BDBM50573234

Cc1ccc(cc1)-c1n[nH]cc1N1CCCNCC1

BDBM50573235

Clc1cccc(c1)-c1n[nH]cc1N1CCCNCC1