138 SMILES Strings for Protein arginine N-methyltransferase 6
Compound Name
SMILES String
C1CN=C(N1)c1cc2cc(ccc2o1)-c1cc2ccc(cc2[nH]1)C1=NCCN1 |c:2,t:28|
CC(=O)Nc1ccc(cc1)N=Nc1c(O)c2ccc(NC(=O)Nc3ccc4c(O)c(N=Nc5ccccc5)c(cc4c3)S(O)(=O)=O)cc2cc1S(O)(=O)=O |w:31.32,11.12|
CC(=O)O[C@@H]1[C@@H](C[C@H](CC[C@H](N)C(O)=O)CNC(N)=N)O[C@H]([C@@H]1OC(C)=O)n1cnc2c(NC(=O)c3ccccc3)ncnc12 |r|
CC(C)Cc1ccc(cc1)-c1[nH]ncc1CN(C)CCN
CC(C)Oc1c(Cl)cc(cc1C(F)(F)F)-c1c[nH]nc1CN(C)CCN
CC(C)Oc1ccc(cc1)-c1[nH]ncc1CN(C)CCN
CC(C)Oc1ccc(cc1)-c1c[nH]cc1CN(C)CCN
CC(C)Oc1ccc(cc1Cl)-c1[nH]ncc1CN(C)CCN
CC(N)C(=O)NCc1ccc(Oc2ccccc2F)c(F)c1
CCC(=O)Nc1cccc(c1)-c1c[nH]cc1CN(C)CCN
CCC(C)(C)c1ccc(COC2CCN(CCNC)CC2)cc1
CCC(CO)Oc1ccc(cc1)-c1[nH]ncc1CN(C)CCNC
CCC(N(C)CCN)c1ccc(OC)cc1
CCNC(=O)[C@@H](C)N |r|
CCNCCN1CCC(Cc2ccccc2)CC1
CCOCC1(COCC)CCC(CC1)c1c(CN(C)CCNC)nn2CCCc12
CCOc1ccc(cc1)-c1[nH]ncc1CN(C)CCNC
CCn1c2cccc3cccc(c23)\c1=C\[CH+]\C=c1/n(CC)c2cccc3cccc1c23
CN(C)Cc1ccc(CSCCN)o1
CN(CCN)Cc1c[nH]cc1-c1cccc(NC(=O)C=C)c1
CN(CCN)Cc1c[nH]cc1-c1cccc(c1)C(F)(F)F
CN(CCN)Cc1c[nH]nc1-c1ccc(OCCCN2CCOCC2)cc1
CN(CCN)Cc1c[nH]nc1-c1ccc(cc1)N1CCN(CC1)C(=O)Cc1ccccc1
CN(CCN)Cc1ccccc1
CN(CCN)Cc1ccccc1Sc1ccccc1Cl
CN(CCN)Cc1cn[nH]c1-c1ccc(F)cc1
CN(CCN)Cc1cn[nH]c1-c1ccc(Oc2ccccc2)cc1
CN(CCN)Cc1n[nH]nc1-c1cccc(c1)C(F)(F)F
CN(CCO)Cc1c[nH]cc1-c1cccc(NC(=O)C=C)c1
CN1CCCN(Cc2ccc(CN)cc2)CC1
CNC(=N)N\N=C(\C)c1ccc2oc3ccc(cc3c2c1)C(\C)=N\NC(=N)NC
CNCC(=O)NC1=CC2C(C=C1)C(=O)c1cc(NC(=O)CNC)ccc1C2=O |c:10,t:6|
CNCC(O)CN1CCC(Cc2ccccc2)CC1
CNCC(O)CN1CCc2c(Br)cccc2C1
CNCCCN1CCC(Cc2ccccc2)CC1
CNCCN(C)C
CNCCN(C)Cc1c[nH]nc1-c1ccc(O[C@H]2C[C@@H](C2)OCCC2CCOCC2)cc1 |r,wU:17.17,wD:19.22,(9.1,4.97,;7.93,4.58,;7.61,3.08,;6.15,2.59,;5.83,1.08,;6.75,.26,;4.37,.6,;4.06,-.91,;5.09,-2.05,;4.31,-3.38,;2.81,-3.06,;2.67,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-2.67,1.54,;-4,.77,;-4.35,-.7,;-5.84,-.3,;-5.45,1.19,;-7.17,-1.07,;-8.5,-.31,;-9.84,-1.08,;-11.17,-.31,;-12.51,-1.08,;-13.84,-.31,;-13.84,1.23,;-12.51,2,;-11.17,1.23,;-1.33,-.77,;,-1.54,)|
CNCCN(C)Cc1c[nH]nc1-c1ccc(Oc2cccc(c2)C(=O)N(C)C)cc1
CNCCN(C)Cc1cn[nH]c1-c1cc(OC(CO)CC(C)C)cc(c1)C(F)(F)F
CNCCN(C)Cc1cn[nH]c1-c1cc(OCCC2CCCCC2)cc(c1)C(F)(F)F
CNCCN(C)Cc1cn[nH]c1-c1cc(OCCc2ccccc2)cc(c1)C(F)(F)F
CNCCN(C)Cc1cn[nH]c1-c1ccc(OC(C)C)c(Cl)c1
CNCCN(C)Cc1cn[nH]c1-c1ccc(OC(C)C)cc1
CNCCN(C)Cc1cn[nH]c1-c1ccc(OC(CO)C(C)C)cc1
CNCCN(C)Cc1cnn(C)c1-c1ccc(OC(C)C)c(Cl)c1
CNCCN(C)Cc1n[nH]cc1-c1ccc(Oc2cccc(c2)C(=O)N(C)C)cc1
CNCCN(C)Cc1n[nH]cc1-c1ccc(Oc2ccccc2C(=O)NC)cc1
CNCCN(C)Cc1nn2CCCCc2c1C1CCCCC1
CNCCN(C)Cc1nn2CCCc2c1C1CCC(C)(C)CC1
CNCCN(C)Cc1nn2CCCc2c1C1CCC2(CCCC2)CC1
CNCCN(C)Cc1nn2CCCc2c1C1CCCCC1
CNCCN1CCC(C)CC1
CNCCN1CCC(CC1)C(=O)Nc1ccccc1
CNCCN1CCC(CC1)C(O)c1ccccc1
CNCCN1CCC(CC1)NC(=O)c1ccccc1
CNCCN1CCC(CC1)Nc1ccccc1
CNCCN1CCC(CC1)OC(=O)c1ccccc1
CNCCN1CCC(CC1)OCc1ccc(Br)cc1
CNCCN1CCC(CC1)OCc1ccc(CC(C)C)cc1
CNCCN1CCC(CC1)OCc1ccc(Cl)cc1
CNCCN1CCC(CC1)OCc1ccc(F)cc1
CNCCN1CCC(CC1)OCc1ccc(OC(F)(F)F)cc1
CNCCN1CCC(CC1)OCc1ccc(OCC(F)(F)F)cc1
CNCCN1CCC(CC1)OCc1ccc(Oc2cccc(Cl)c2Cl)cc1
CNCCN1CCC(CC1)OCc1ccc(cc1)-c1ccccc1
CNCCN1CCC(CC1)OCc1ccc(cc1)-n1nc(C)cc1C
CNCCN1CCC(CC1)OCc1ccc(cc1)C(F)(F)F
CNCCN1CCC(CC1)OCc1ccc(cc1)C1CCCCC1
CNCCN1CCC(CC1)OCc1cccc(Br)c1
CNCCN1CCC(CC1)OCc1cccc(Cl)c1
CNCCN1CCC(CC1)OCc1cccc(F)c1
CNCCN1CCC(CC1)OCc1cccc(c1)-c1ccccc1
CNCCN1CCC(CC1)OCc1cccc(c1)C(F)(F)F
CNCCN1CCC(CC1)OCc1ccccc1
CNCCN1CCC(CC1)OCc1ccccc1-c1ccccc1
CNCCN1CCC(CC1)OCc1ccccc1Br
CNCCN1CCC(CC1)OCc1ccccc1C(F)(F)F
CNCCN1CCC(CC1)OCc1ccccc1Cl
CNCCN1CCC(CC1)OCc1ccccc1F
CNCCN1CCC(CC1)Oc1ccccc1
CNCCN1CCC(CC1)Sc1ccccc1
CNCCN1CCC(CC1)c1ccccc1
CNCCN1CCC(CCc2ccccc2)CC1
CNCCN1CCC(CNc2ccccc2)CC1
CNCCN1CCC(COC(=O)c2ccccc2)CC1
CNCCN1CCC(COc2ccccc2)CC1
CNCCN1CCC(Cc2ccccc2)C1
CNCCN1CCC(Cc2ccccc2)CC1
CNCCN1CCCC(Cc2ccccc2)C1
CNCCN1CCCC1
CNCCNC1CCN(CC1)c1cccc(c1)-c1ccnc(C)n1
CNC[C@@H](O)CN1CCc2c(C1)cccc2OCc1ccc(cc1)-c1nccs1 |r|
CNCc1ccc(C)s1
CNCc1cccc(c1)-c1cccnc1
CNCc1cccc(c1)-c1ccco1
CNCc1cccc(c1)-c1cccs1
CNCc1cccc(c1)-c1ccncc1
CNCc1cccc(c1)-c1ccsc1
CNCc1cccc(c1)-c1csc(C)n1
CNCc1cccc(c1)N1CCCCC1
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCCCCNC(=N)NC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCCNC(=N)NC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCNC(=N)NCCC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCNC(=N)NCC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCNC(=N)NC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCCNC(=N)NC\C=C\[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2cc(NC(=O)NCCCNC(=N)NC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2c1 |r|
COC(=O)c1cc(O)c2ccc(NC(=O)NCCCCCCNC(=N)NC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)cc2c1 |r|
COC(=O)c1ccccc1NC(=O)CSc1nc2cc(OC)ccc2[nH]1
C[C@H](N)C(=O)NCc1cccnc1Oc1ccc(F)c(F)c1 |r|
C[C@H](N)C(=O)NCc1cccnc1Oc1ccc(F)cc1F |r|
Cc1ccc2NC(=O)CN(C(c3cc(C)cc(C)c3)c2c1)C(=O)c1ccc(Br)s1
Cc1ccc2NC(=O)CN(C(c3ccc(F)cc3)c2c1)C(=O)c1ccc(Br)o1
Cc1ccc2NC(=O)CN([C@@H](c3cc(C)cc(C)c3)c2c1)C(=O)c1ccc(Br)s1 |r|
Cc1ccc2NC(=O)CN([C@@H](c3ccc(F)cc3)c2c1)C(=O)c1ccc(Br)o1 |r|
Cc1ccc2NC(=O)CN([C@H](c3cc(C)cc(C)c3)c2c1)C(=O)c1ccc(Br)o1 |r|
Cc1ccc2NC(=O)CN([C@H](c3cc(C)cc(C)c3)c2c1)C(=O)c1ccc(Br)s1 |r|
Cc1ccc2NC(=O)CN([C@H](c3ccc(F)cc3)c2c1)C(=O)c1ccc(Br)o1 |r|
Cc1nc(N)sc1-n1ccc(n1)C(F)(F)F
Cl.COc1ccccc1Oc1ccc(CNC(=O)[C@H](C)N)cc1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2cc(C)cc(C)c2)c(C)c1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2cc(Cl)cc(Cl)c2)cc1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2ccc(F)cc2)c(C)c1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2cccc(Cl)c2Cl)cc1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2cccc3ccccc23)cc1 |r|
Cl.C[C@H](N)C(=O)NCc1ccc(Oc2ccccc2F)c(F)c1 |r|
Cl.Cl.CNCCNCc1ccc(Oc2ccccc2F)c(F)c1
NC(=N)c1ccc(Nc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C(N)=N)cc1
NC(=N)c1ccc(Nc2ncnc(Nc3ccc(cc3)C#N)c2[N+]([O-])=O)cc1
NC(=N)c1ccc(\C=C\c2ccc(cc2)C(N)=N)cc1
NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N |w:1.0,20.23|
NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(nc1)C(N)=N
NC(=O)N\N=C\c1ccc(o1)-c1ccc(Cl)cc1
NCCN1CCC(Cc2ccccc2)CC1
NCc1cccc(CN2CCCC2)c1
Nc1ccc(cc1)S(=O)(=O)Nc1nccs1
Nc1nc(N)c2nc3c(ccc4ccccc34)nc2n1
O[C@@H](CNC(=O)c1ccc2CN(CCc2c1)C(=O)c1ccc(Br)cc1)CN1CCc2ccccc2C1 |r|