460 SMILES Strings for Microtubule-associated protein tau

Compound Name
SMILES String
C(CN1CCOCC1)Oc1cccc(\C=C\c2cc(\C=C\c3ccc4cc[nH]c4c3)[nH]n2)c1
C1CCN(C1)c1ccc(\C=C\c2cc(\C=C\c3ccc(cc3)N3CCCC3)ncn2)cc1
C1CCN(CC1)c1ccc(\C=C\c2cc(\C=C\c3ccc(cc3)N3CCCCC3)ncn2)cc1
C1CCN2\C(Sc3ccccc23)=C\C=C\c2sc3ccccc3[n+]2CCCCCN2\C(Sc3ccccc23)=C\C=C\c2sc3ccccc3[n+]2CC1 |t:13,15,43,45|
C1CN(CCN1)c1ncc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
C1CN(CCN1c1cccnc1)c1ccc2c(n1)[nH]c1ccncc21
C1CN(CCN1c1ccncc1)c1ccc2c(n1)[nH]c1ccncc21
C1CN(CCO1)c1ccc(\C=C\c2cc(c(\C=C\c3ccc(cc3)N3CCOCC3)nn2)-c2ccccc2)cc1
C1CN(CCO1)c1ccc(\C=C\c2cnc(\C=C\c3ccc(cc3)N3CCOCC3)cn2)cc1
C1CN(CCO1)c1ccc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
C1CN(CCO1)c1ncc(s1)-c1ccc2c(n1)[nH]c1ccncc21
C1CN(CCO1)c1nccc(n1)-c1ccc2c(n1)[nH]c1ccncc21
C1CNc2cc(ncc2C1)-n1ccc2ccncc12
CC#Cc1ccc(nc1)-n1ccc2ccncc12
CC#Cc1cnc(cc1CF)-n1ccc2ccncc12
CC#Cc1cnc(cc1CO)-n1ccc2ccncc12
CC#Cc1cnc(cc1F)-n1ccc2ccncc12
CC(=O)CCc1oc2cc(Br)ccc2c1-c1ccc(C)o1
CC(=O)CCc1oc2cc(ccc2c1-c1ccc(C)o1)-c1cccnc1
CC(=O)CCc1oc2cc(ccc2c1-c1ccc(C)o1)-c1ccncc1
CC(=O)CCc1oc2ccc(Br)cc2c1CCc1ccc(C)cc1
CC(=O)CCc1oc2ccc(cc2c1-c1ccc(C)o1)-c1cccc(O)c1
CC(=O)CCc1oc2ccc(cc2c1-c1ccc(C)o1)-c1cccnc1
CC(=O)CCc1oc2ccc(cc2c1-c1ccc(C)o1)-c1cccs1
CC(=O)CCc1oc2ccc(cc2c1-c1ccc(C)o1)-c1ccncc1
CC(=O)CCc1oc2ccc(cc2c1-c1ccc(Cl)s1)-c1ccc(Cl)nc1
CC(=O)CCc1oc2ccc(cc2c1-c1ccc(Cl)s1)-c1ccncc1
CC(=O)N1CCN(CC1)c1ncc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
CC(=O)N1N=C(CC1c1ccc(O)c(O)c1)c1ccc(O)c(O)c1 |c:4|
CC(C)(C)n1c2cc(sc2c2sc(cc12)-c1ccc(cc1)N(c1ccccc1)c1ccccc1)-c1ccc(C=O)s1
CC(C)(C)n1c2cc(sc2c2sc(cc12)-c1ccc(cc1)N(c1ccccc1)c1ccccc1)-c1ccc(\C=C(/C#N)C(N)=O)s1
CC(C)CCc1c(CCC(C)=O)oc2ccc(Br)cc12
CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(O)=O |r|
CC(C)Oc1ccncc1NC(=O)c1ccnn2c(NC(=O)C3CC3)cnc12
CC(C)Oc1ccncc1NC(=O)c1ccnn2c(NC(=O)C3CCC3)cnc12
CC(C)Oc1ccncc1NC(=O)c1ccnn2c(NCC3CC3)cnc12
CC(C)Oc1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
CC1CN(CCO1)c1cc(F)ncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
CC1CN(CCO1)c1ccncc1NC(=O)c1ccnn2c(NCC3CC3)cnc12
CC1CN(CCO1)c1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccc(cc1)C(F)(F)F
CC1CN(CCO1)c1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
CC1CN(CCO1)c1ccncc1NC(=O)c1ccnn2cc(nc12)C1=CCCCC1 |t:29|
CC1CN(CCO1)c1ccncc1NC(=O)c1ccnn2cc(nc12)C1CC1
CC1CN(CCO1)c1ccncc1NC(=O)c1ccnn2ccnc12
CCCC(=O)Nc1n[nH]c2c(F)c(Cl)c(cc12)-c1ccccc1
CCCC(=O)Nc1n[nH]c2cc(Cl)c(cc12)-c1ccccc1
CCCC[N+]1=C(\C=C\c2ccc(cc2)N(CC)CC)C(C)(C)c2ccccc12 |c:4|
CCCN(CCN1CCN(CC1)c1ccc(cc1)-c1ccc(O)c(O)c1)[C@H]1CCc2c(O)cccc2C1 |r|
CCCN(CCN1CCN(CC1)c1ccc(cc1)-c1ccc(O)c(O)c1)[C@H]1CCc2nc(N)sc2C1 |r|
CCN(CC)c1ccc(cc1)-c1ccc2cc(OCC(O)CF)ccc2n1
CCNc1cc(ccn1)-c1ccc(nc1)-n1ccc2ccncc12
CCNc1ccc(cc1)-c1ccc2cc(OCC(O)CF)ccc2n1
CCOC(=O)N1C(=O)\C(=C/C=C/c2ccc(cc2)N(C)C)c2ccccc12
CCOC(=O)N1C(=O)\C(=C/c2ccc(cc2)N(C)C)c2ccccc12
CCOc1ncncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(O)=O |r|
CC\C(=C/c1sc2ccc(OC)cc2[n+]1CCO)\C=C1/Sc2ccc(OC)cc2N1CCO
CN(C)C(=O)c1ccc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
CN(C)c1cc2[nH]c3nc(ccc3c2cn1)-c1ccc(F)nc1
CN(C)c1cc2[nH]c3nc(ccc3c2cn1)-c1cnn(C)c1
CN(C)c1ccc(C=C2C(=O)Nc3ccc(I)cc23)cc1
CN(C)c1ccc(C=Cc2nc3ccc(I)cc3[nH]2)cc1 |w:8.8|
CN(C)c1ccc(\C=C2/C(=O)N(C)c3ccccc23)cc1
CN(C)c1ccc(\C=C2/C(=O)N(Cc3ccccc3)c3ccccc23)cc1
CN(C)c1ccc(\C=C2/C(=O)N(Cc3ccccc3)c3ncccc23)cc1
CN(C)c1ccc(\C=C2/C(=O)N(c3ccccc23)c2ccccc2)cc1
CN(C)c1ccc(\C=C2/C(=O)N(c3ccccc23)c2ccncc2)cc1
CN(C)c1ccc(\C=C2/C(=O)Nc3ccc(O)cc23)cc1
CN(C)c1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
CN(C)c1ccc(\C=C2/C(=O)Nc3ncccc23)cc1
CN(C)c1ccc(\C=C2/Nc3ccc(I)cc3C2=O)cc1
CN(C)c1ccc(\C=C\C=C2/C(=O)N(C)c3ccccc23)cc1
CN(C)c1ccc(\C=C\C=C2/C(=O)N(Cc3ccc(N)cc3)c3ccccc23)cc1
CN(C)c1ccc(\C=C\C=C2/C(=O)N(Cc3ccc(cc3)[N+]([O-])=O)c3ccccc23)cc1
CN(C)c1ccc(\C=C\C=C2/C(=O)N(Cc3ccccc3)c3ccccc23)cc1
CN(C)c1ccc(\C=C\C=C2/C(=O)N(Cc3ccccc3)c3ncccc23)cc1
CN(C)c1ccc(\C=C\C=C2/C(=O)N(c3ccccc23)c2ccccc2)cc1
CN(C)c1ccc(\C=C\C=C2/C(=O)N(c3ccccc23)c2ccncc2)cc1
CN(C)c1ccc(\C=C\C=C2/C(=O)Nc3ccc(O)cc23)cc1
CN(C)c1ccc(\C=C\C=C2/C(=O)Nc3ccccc23)cc1
CN(C)c1ccc(\C=C\C=C2/C(=O)Nc3ncccc23)cc1
CN(C)c1ccc(\C=C\C=C\c2cc(\C=C\C=C\c3ccc(cc3)N(C)C)ncn2)cc1
CN(C)c1ccc(\C=C\c2cc(\C=C\c3ccc(cc3)N(C)C)ncn2)cc1
CN(C)c1ccc(\C=C\c2cc(c(\C=C\c3ccc(cc3)N(C)C)nn2)-c2ccccc2F)cc1
CN(C)c1ccc(c(F)n1)-c1ccc(cc1)-c1cn2cc(OCCOCCOCCOCCOCCOCCOc3ccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c4c3)ccc2n1
CN(C)c1ccc(cc1)\N=N\c1nc2ccc(I)cc2s1
CN(C)c1ccc(cc1)\N=N\c1nc2ccc(OCCOCCOCCF)cc2s1
CN(C)c1ccc(cn1)-c1ccc(cc1)-c1nc2ccc(NCCOCCN3C(=O)CCC(N4Cc5cc(O)ccc5C4=O)C3=O)cc2s1
CN(C)c1ccc(cn1)-c1ccc(cc1)-c1nc2ccc(NCCOCCOCCOCCOCCOCCOc3ccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c4c3)cc2s1
CN(C)c1ccc(cn1)-c1ccc(cc1)-c1nc2ccc(NCCOCCOCCOCCOCCOCCOc3ccc4C(=O)N(Cc4c3)C3CCC(=O)NC3=O)cc2s1
CN(C)c1ccc(cn1)-c1ccc(cc1)-c1nc2ccc(NCCOCCOc3ccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c4c3)cc2s1
CN(C)c1ccc(cn1)-c1ccc(cc1)-c1nc2ccc(NCCOCCOc3ccc4C(=O)N(Cc4c3)C3CCC(=O)NC3=O)cc2s1
CN(C)c1ccc(cn1)-c1ccc(nc1)-n1ccc2ccncc12
CN(C)c1ccc(cn1)-c1ccc2cc(OCC(O)CF)ccc2n1
CN(C)c1ccc2cnc(cc2c1)-n1ccc2ccncc12
CN(C)c1ccc2nc(sc2c1)-c1ccc(cc1)-c1ccc(NCCOCCOCCOCCOCCOCCOc2ccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c3c2)nc1
CN(C)c1ccc2nc(sc2c1)-c1ccc(cc1)-c1ccc(NCCOCCOCCOCCOCCOCCOc2ccc3C(=O)N(Cc3c2)C2CCC(=O)NC2=O)nc1
CN(C)c1ccc2nc3ccc(cc3sc2c1)=[N+](C)C |(-6.69,-.96,;-5.34,-1.73,;-5.34,-3.28,;-4,-.96,;-4,.55,;-2.67,1.33,;-1.33,.55,;,1.33,;1.33,.55,;2.66,1.33,;4,.55,;4,-.96,;2.66,-1.73,;1.33,-.96,;,-1.73,;-1.33,-.96,;-2.67,-1.73,;5.34,-1.73,;5.34,-3.28,;6.68,-.96,)|
CN(C)c1ccc2nc3ccc(cc3sc2c1)=[N+](C)C |(17.73,-40.24,;19.06,-41.01,;19.06,-42.55,;20.39,-40.24,;20.4,-38.7,;21.73,-37.93,;23.06,-38.69,;24.39,-37.91,;25.73,-38.69,;27.06,-37.93,;28.39,-38.69,;28.39,-40.23,;27.06,-41,;25.73,-40.23,;24.39,-41.01,;23.06,-40.24,;21.73,-41.01,;29.73,-41,;29.73,-42.54,;31.06,-40.23,)|
CN(CCF)c1ccc2cnc(cc2c1)-n1ccc2ccncc12
CN(CCO)c1ccc2cnc(cc2c1)-n1ccc2ccncc12
CN(CCc1ccc(cc1)[N+]([O-])=O)c1nc(cc(=O)n1C)-c1ncncc1F
CN1C(=O)CC(N=C1N1CCO[C@H](C1)c1ccc(F)cc1)c1ncncc1F |r,c:6|
CN1CCN(CC1)c1ccc(\C=C\c2cc(\C=C\c3ccc(cc3)N3CCN(C)CC3)ncn2)cc1
CN1CCN(CC1)c1ccc(\C=C\c2cnc(\C=C\c3ccc(cc3)N3CCN(C)CC3)cn2)cc1
CNC(=O)Cn1cc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
CNC(=O)c1ccc(cn1)-c1cc2[nH]c3ncccc3c2cn1
CNC(=O)c1ccc(cn1)-c1ccc2c(n1)[nH]c1cc(C)ncc21
CNC(=O)c1ccc(cn1)-c1ccc2c(n1)[nH]c1cc(COC)ncc21
CNC(=O)c1ccc(cn1)-c1ccc2c(n1)[nH]c1cc(OC)ncc21
CNC(=O)c1ccc(cn1)-c1ccc2c(n1)[nH]c1cc(ncc21)N(C)C
CNC(=O)c1ccc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
CNC(=O)c1ccc(cn1)-c1ccc2c3ccncc3n(COCC[Si](C)(C)C)c2n1
CNC(=O)c1ccc(nc1)-c1ccc2c(n1)[nH]c1ccncc21
CNC(=O)c1ccc(nc1)-c1ccc2c(nc3cc(OC)ncc23)n1
CNc1cc(ccn1)-c1ccc(nc1)-n1ccc2ccncc12
CNc1ccc(C=C2C(=O)Nc3ccc(I)cc23)cc1
CNc1ccc(C=C2Nc3ccc(I)cc3C2=O)cc1 |w:6.5|
CNc1ccc(C=Cc2nc3ccc(I)cc3[nH]2)cc1 |w:7.7|
CNc1ccc(cc1)-c1ccc2cc(OCC(O)CF)ccc2n1
CNc1ccc(cc1)-c1ccc2ccccc2n1
CNc1ccc(cc1)-c1nc2ccc(O)cc2s1
CNc1ccc(cn1)-c1ccc(nc1)-n1ccc2ccncc12
CNc1ccc(cn1)-c1ccc2c(n1)[nH]c1cnccc21
CNc1ccc(cn1)-c1ccc2cc(OCC(O)CF)ccc2n1
CNc1ccc(cn1)C(=O)Nc1ccc2c(n1)[nH]c1ccncc21
CNc1ccc2cnc(cc2c1)-n1ccc2ccncc12
CNc1cccc(c1)-c1ccc(nc1)-n1ccc2ccncc12
CNc1ncc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
COCCNC(=O)c1ccc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
COCCNc1ncc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
COCc1cc2[nH]c3nc(ccc3c2cn1)-c1ccc(F)nc1
COCc1cc2[nH]c3nc(ccc3c2cn1)-c1cnn(C)c1
COc1cc(O)cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)c1
COc1cc(O)ccc1\C=C\C(=O)CC(=O)\C=C\c1ccc(O)cc1OC
COc1cc(O)ccc1\C=C\C(=O)CC(=O)\C=C\c1ccc2cc[nH]c2c1
COc1cc(OCC2CCCO2)ccc1\C=C\C(=O)CC(=O)\C=C\c1ccc2cc[nH]c2c1
COc1cc(OCc2ccccc2)ccc1\C=C\C(=O)CC(=O)\C=C\c1ccc2cc[nH]c2c1
COc1cc(OCc2ccccn2)ccc1\C=C\C(=O)CC(=O)\C=C\c1ccc2cc[nH]c2c1
COc1cc(OCc2ccccn2)ccc1\C=C\c1cc(\C=C\c2ccc(C)n2C)[nH]n1
COc1cc(OCc2ccccn2)ccc1\C=C\c1cc(\C=C\c2ccc3cc[nH]c3c2)[nH]n1
COc1cc(OCc2ccccn2)ccc1\C=C\c1cc(\C=C\c2cccc(C)n2)[nH]n1
COc1cc(OCc2ccccn2)ccc1\C=C\c1cc(\C=C\c2cccn2C)[nH]n1
COc1cc(OCc2ccccn2)ccc1\C=C\c1cc(\C=C\c2ccnn2C)[nH]n1
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2c(O)cccc2OC)ccc1O
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2cc(O)ccc2OC)ccc1O
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)cc2OC)ccc1O
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc3OCOc3c2)ccc1O
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc3cc[nH]c3c2)ccc1O
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc3ccccc3c2)ccc1O
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2cccc(O)c2OC)ccc1O
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccccc2)ccc1O
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2cccnc2)ccc1O
COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccco2)ccc1O
COc1cc(\C=C\C(=O)Oc2cc(O)c3C(=O)[C@H](O)[C@H](Oc3c2)c2ccc3O[C@@H](CO)[C@@H](Oc3c2)c2ccc(O)c(OC)c2)ccc1O |r|
COc1cc(\C=C\C(=O)Oc2cc(O)c3C(=O)[C@H](O)[C@H](Oc3c2)c2ccc3O[C@H](CO)[C@H](Oc3c2)c2ccc(O)c(OC)c2)ccc1O |r|
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)[nH]n2)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)n(C)n2)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)n(CCO)n2)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)n(Cc3ccccc3)n2)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)n(n2)-c2cc(Cl)cc(Cl)c2)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)n(n2)-c2ccc(C)cc2)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)n(n2)-c2ccc(Cl)nn2)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)n(n2)-c2ccc(cc2)C(C)C)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)n(n2)-c2ccc(cc2)[N+]([O-])=O)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)n(n2)-c2cccc(c2)[N+]([O-])=O)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)n(n2)-c2ccccc2)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(O)c(OC)c3)on2)ccc1O
COc1cc(\C=C\c2cc(\C=C\c3ccc(OCC(=O)OC(C)(C)C)c(OC)c3)on2)ccc1OCC(=O)OC(C)(C)C
COc1cc(\C=C\c2cc(\C=C\c3ccc(OCC(O)=O)c(OC)c3)on2)ccc1OCC(O)=O
COc1cc(\C=C\c2ccc(O)cc2)ccc1\C=C\c1ccc(O)cc1
COc1cc(\C=c2/sc3nc(cn3c2=O)-c2ccc(Cl)cc2)cc(Br)c1O
COc1cc(\C=c2/sc3nc(cn3c2=O)-c2ccc(Cl)cc2)cc(Cl)c1O
COc1cc(\C=c2/sc3nc(cn3c2=O)-c2ccc(Cl)cc2)cc(O)c1O
COc1cc(\C=c2/sc3nc(cn3c2=O)-c2ccc(Cl)cc2)cc(OC)c1O
COc1cc(\C=c2/sc3nc(cn3c2=O)-c2cccc(Cl)c2)cc(OC)c1O
COc1cc(\C=c2/sc3nc(cn3c2=O)-c2cccc(OC(F)(F)F)c2)cc(F)c1O
COc1cc(\C=c2/sc3nc(cn3c2=O)-c2cccc(c2)C(F)(F)F)cc(Cl)c1O
COc1cc(\C=c2/sc3nc(cn3c2=O)-c2ccncc2)cc(OC)c1O
COc1cc(\C=c2/sc3nc(cn3c2=O)-c2ccncc2C)cc(OC)c1O
COc1cc(\C=c2/sc3nc(cn3c2=O)-c2ccncc2C)ccc1O
COc1cc(ccn1)-c1ccc2c(c(CCC(C)=O)oc2c1)-c1ccc(C)o1
COc1cc(ccn1)-c1ccc2c(n1)[nH]c1ccncc21
COc1cc(ccn1)-c1ccc2oc(CCC(C)=O)c(-c3ccc(C)o3)c2c1
COc1cc(ccn1)-c1ccc2oc(CCC(C)=O)c(-c3ccc(Cl)s3)c2c1
COc1cc(ncc1C#CC)-n1ccc2ccncc12
COc1cc2[nH]c3nc(ccc3c2cn1)-c1ccc(F)nc1
COc1cc2[nH]c3nc(ccc3c2cn1)-c1cnc(Cl)nc1
COc1cc2[nH]c3nc(ccc3c2cn1)-c1cnc(nc1)N1CCOCC1
COc1cc2[nH]c3nc(ccc3c2cn1)-c1cnn(C)c1
COc1cc2ccn(-c3cc4cc(F)ccc4cn3)c2cn1
COc1ccc(CCNc2nc(cc(=O)n2C)-c2ncncc2F)cc1OC
COc1ccc(CN2C(=O)\C(=C/C=C/c3ccc(cc3)N(C)C)c3ccccc23)cc1
COc1ccc(CN2C(=O)\C(=C/C=C/c3ccc(cc3)N(C)C)c3cccnc23)cc1
COc1ccc(CN2C(=O)\C(=C/C=C/c3ccc(cc3)[N+]([O-])=O)c3ccccc23)cc1
COc1ccc(CN2C(=O)\C(=C/C=C/c3ccc(cc3)[N+]([O-])=O)c3ccccc23)cc1OC
COc1ccc(CN2C(=O)\C(=C/c3ccc(cc3)N(C)C)c3ccccc23)cc1
COc1ccc(CN2C(=O)\C(=C/c3ccc(cc3)N(C)C)c3cccnc23)cc1
COc1ccc(CN2C(=O)\C(=C\C=C\c3ccc(cc3)[N+]([O-])=O)c3ccccc23)cc1
COc1ccc(CN2C(=O)\C(=C\C=C\c3ccc(cc3)[N+]([O-])=O)c3ccccc23)cc1OC
COc1ccc(NC(=O)c2ccc(nc2)-n2ccc3ccncc23)cc1
COc1ccc(O)c(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)c1
COc1ccc(OC)c(c1)C1=CC(NC(=S)N1)c1c(OC)cc(OC)cc1OC |t:11|
COc1ccc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)c(O)c1
COc1ccc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)cc1O
COc1ccc(\C=C\C(=O)CC(=O)\C=C\c2ccc3cc[nH]c3c2)c(OC)c1
COc1ccc(\C=C\C=C2/C(=O)N(Cc3ccccc3)c3ccccc23)cc1
COc1ccc(\C=C\C=C2/C(=O)Nc3ccccc23)cc1
COc1ccc(\C=C\c2cnc(\C=C\c3ccc(OC)cc3)cn2)cc1
COc1ccc(cc1)-c1cc(\C=C\c2ccc(cc2)N(C)C)nnc1\C=C\c1ccc(cc1)N(C)C
COc1ccc(cc1)-c1cc2n(c3cc(sc3c2s1)-c1ccc(C=O)s1)C(C)(C)C
COc1ccc(cc1)-c1cc2n(c3cc(sc3c2s1)-c1ccc(\C=C(/C#N)C(N)=O)s1)C(C)(C)C
COc1ccc(cc1)-c1ccc(s1)-c1ccc(C=O)s1
COc1ccc(cc1O)C1NC(=S)NC(=C1)c1cc(OC)c(OC)c(OC)c1 |c:15|
COc1ccc(cn1)-c1ccc2c(c(CCC(C)=O)oc2c1)-c1ccc(C)o1
COc1ccc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
COc1ccc(cn1)-c1ccc2oc(CCC(C)=O)c(-c3ccc(C)o3)c2c1
COc1ccc2cc(ncc2c1)-n1ccc2ccncc12
COc1ccc2nc(ncc2c1)-n1ccc2ccncc12
COc1cccc(CN2C(=O)\C(=C/C=C/c3ccc(cc3)[N+]([O-])=O)c3ccccc23)c1
COc1cccc(CN2C(=O)\C(=C\C=C\c3ccc(cc3)[N+]([O-])=O)c3ccccc23)c1
COc1cccc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)c1O
COc1cccc(c1)-c1ccc2oc(CCC(C)=O)c(-c3ccc(C)o3)c2c1
COc1cccc2cc(ncc12)-n1ccc2ccncc12
COc1cccc2cnc(cc12)-n1ccc2ccncc12
COc1ccccc1-c1cn2nccc(C(=O)Nc3cnccc3N3CCC(F)(F)CC3)c2n1
COc1ccccc1-c1cn2nccc(C(=O)Nc3cnccc3N3CCOC(C)C3)c2n1
COc1cnn(c1)-c1ccc2c(n1)[nH]c1ccncc21
COc1cnn(c1)-c1ccc2c(n1)[nH]c1cnccc21
COc1ncc(cc1F)-c1ccc2c(n1)[nH]c1ccncc21
COc1nccc2cnc(cc12)-n1ccc2ccncc12
CS(=O)(=O)c1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
CS(O)(=O)=O.CS(O)(=O)=O.CN(C)C1C=CC2Nc3ccc(cc3SC2=C1)N(C)C |c:12,25|
C[C@@H]1COCCN1c1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1 |r|
C[C@@H]1COCCN1c1nc(cc(=O)n1C)-c1ncncc1F |r|
C[C@H]1COCCN1c1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1 |r|
C[N+](C)=c1ccc2nc3ccc(N)cc3sc2c1 |(14.23,-9.19,;14.24,-7.65,;15.58,-6.89,;12.91,-6.88,;12.92,-5.34,;11.59,-4.55,;10.26,-5.32,;8.92,-4.54,;7.58,-5.32,;6.25,-4.56,;4.92,-5.33,;4.92,-6.87,;3.59,-7.64,;6.25,-7.64,;7.58,-6.86,;8.91,-7.64,;10.25,-6.86,;11.57,-7.64,)|
C[N+]1=C(\C=C\c2ccc(cc2)N2CCCC2)C(C)(C)c2ccccc12 |c:1|
Cc1c(OCC(F)(F)F)ccnc1CS(=O)c1nc2ccccc2[nH]1
Cc1c(OCC(F)(F)F)ccnc1CS(=O)c1nc2ccccc2n1C
Cc1cc(OCc2ccccn2)ccc1\C=C\c1cc(\C=C\c2cccn2C)[nH]n1
Cc1cc(n[nH]1)-c1ccc2c(n1)[nH]c1ccncc21
Cc1cc(ncc1C#C)-n1ccc2ccncc12
Cc1cc(ncc1C#CCF)-n1ccc2ccncc12
Cc1cc(ncc1OCCF)-n1ccc2ccncc12
Cc1cc2[nH]c3nc(ccc3c2cn1)-c1ccc(F)nc1
Cc1cc2[nH]c3nc(ccc3c2cn1)-c1cnn(C)c1
Cc1cc2cnc(cc2o1)-n1ccc2ccncc12
Cc1cc2nc3ccc(cc3sc2cc1N)=[N+](C)C |(19,-12.67,;17.67,-11.9,;16.33,-12.67,;15,-11.9,;13.67,-12.67,;12.34,-11.9,;11,-12.67,;9.67,-11.9,;9.67,-10.36,;11,-9.59,;12.34,-10.36,;13.67,-9.59,;15,-10.36,;16.33,-9.59,;17.67,-10.36,;19,-9.59,;8.33,-9.59,;7,-10.36,;8.33,-8.05,)|
Cc1ccc(cc1)C(=O)N\N=C\c1ccc(O)c(O)c1O
Cc1ccc(o1)-c1c(CCC(=O)N2CCC(O)CC2)oc2ccc(Br)cc12
Cc1ccc(o1)-c1c(CCC(C)(C)O)oc2ccc(Br)cc12
Cc1ccc(o1)-c1c(CCC(C)(O)c2ccc(C)cc2)oc2ccc(Br)cc12
Cc1ccc(o1)-c1c(CCC(O)=O)oc2ccc(Br)cc12
Cc1ccc(o1)-c1c(CCc2nc3ccccc3[nH]2)oc2ccc(Br)cc12
Cc1cccc(N2CCN(CC2)c2nc(cc(=O)n2C)-c2ncncc2F)c1C
Cc1ccncc1NC(=O)c1ccnn2c(NCC3CC3)cnc12
Cc1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
Cc1nc(no1)-c1ccc(cc1)[C@H]1CN(CCO1)c1nc(-c2ccncn2)c(O)c(=O)n1C |r|
Cc1nc(no1)-c1ccc(cc1)[C@H]1CN(CCO1)c1nc(cc(=O)n1C)-c1ncncc1F |r|
ClCCC1CCN(CC1)c1ccc(nc1)-n1ccc2ccncc12
Clc1ccc2[nH]cc(CCNC(=O)c3ccc(cc3)-c3cccc(c3)C#N)c2c1
Clc1ccc2[nH]cc(CCNC(=O)c3cccc(c3)-c3ccccc3C#N)c2c1
Clc1ccc2[nH]cc(CCNC(=O)c3ccccc3-c3ccc(cc3)C#N)c2c1
Cn1c(NCC(=O)c2ccc(Cl)cc2)nc(cc1=O)-c1ncncc1F
Cn1c(nc(cc1=O)-c1ncncc1F)N1CCCC(C1)c1ccc(cc1)N1CCCC1
Cn1c(nc(cc1=O)-c1ncncc1F)N1CCNC(C1)c1ccc(cc1)[N+]#[C-]
Cn1c(nc(cc1=O)-c1ncncc1F)N1CCOC[C@H]1CF |r|
Cn1cc(cn1)-c1cc2[nH]c3ncccc3c2cn1
Cn1cc(cn1)-c1ccc(nc1)-n1ccc2ccncc12
Cn1cc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
Cn1cc(cn1)-c1ccc2c(n1)[nH]c1cnccc21
Cn1ccc(n1)-c1ccc(nc1)-n1ccc2ccncc12
Cn1ccc2cc(ncc12)-n1ccc2ccncc12
Cn1ccc2ccc(\C=C\c3cc(\C=C\c4ccc(OCc5ccccn5)cc4)n[nH]3)cc12
Cn1ccc2ccc(\C=C\c3cc(\C=C\c4ccc(OCc5ccccn5)cc4F)n[nH]3)cc12
Cn1cccc1\C=C\c1cc(\C=C\c2ccc(OCc3ccccn3)cc2)n[nH]1
Cn1cccc1\C=C\c1cc(\C=C\c2ccc(OCc3ccccn3)cc2F)n[nH]1
Cn1cnc(c1)-c1ccc(nc1)-n1ccc2ccncc12
FC(F)(F)COc1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
FC(F)(F)COc1ncncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
FC(F)(F)c1ccc(cc1)-c1cn2nccc(C(=O)Nc3cnccc3N3CCOCC3)c2n1
FC1(F)CCN(CC1)c1ccncc1NC(=O)c1ccnn2c(NCC3CC3)cnc12
FC1(F)CCN(CC1)c1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
FC1(F)CCN(CC1)c1ccncc1NC(=O)c1ccnn2cc(nc12)C1=CCCCC1 |t:30|
FC1(F)CCN(CC1)c1ccncc1NC(=O)c1ccnn2cc(nc12)C1CC1
FC1(F)CCN(CC1)c1ccncc1NC(=O)c1ccnn2ccnc12
FC1CCN(CC1)c1ccc(nc1)-n1ccc2ccncc12
FC1CCN(CC1)c1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
FCC#Cc1ccc(nc1)-n1ccc2ccncc12
FCC#Cc1cnc(cc1C=C)-n1ccc2ccncc12
FCCCC1CCN(CC1)c1ccc2c(n1)[nH]c1ncccc21
FCCCNc1ccc(nc1)-n1ccc2ccncc12
FCCNC(=O)c1ccc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
FCCNc1ccc(nc1)-n1ccc2ccncc12
FCCOc1ccc2cc(ncc2c1)-n1ccc2ccncc12
FCCOc1ccc2nc(ncc2c1)-n1ccc2ccncc12
FCCOc1cccc2cc(ncc12)-n1ccc2ccncc12
FCCOc1cccc2cnc(cc12)-n1ccc2ccncc12
FCCn1cc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
FCCn1ccc(n1)-c1ccc(nc1)-n1ccc2ccncc12
FCCn1ccc(n1)-c1cnc(nc1)-n1ccc2ccncc12
FCOc1ccc2cc(ncc2c1)-n1ccc2ccncc12
FCOc1ccc2cnc(cc2c1)-n1ccc2ccncc12
FCOc1ccc2nc(ncc2c1)-n1ccc2ccncc12
FCOc1cccc2cc(ncc12)-n1ccc2ccncc12
Fc1cc(N2CCC(F)(F)CC2)c(NC(=O)c2ccnn3cc(nc23)-c2ccccc2)cn1
Fc1cc(ccn1)-c1cc2[nH]c3ccncc3c2cn1
Fc1cc(ccn1)-c1cc2[nH]c3cnccc3c2cn1
Fc1cc(ccn1)-c1ccc(nc1)-n1ccc2ccncc12
Fc1cc(ccn1)-c1ccc2c(c1)[nH]c1ccncc21
Fc1cc(ccn1)-c1ccc2c(n1)[nH]c1cccnc21
Fc1cc(ccn1)-c1ccc2c(n1)[nH]c1ccncc21
Fc1cc(ccn1)-c1cnc2c(c1)[nH]c1ccncc21
Fc1cc(ccn1)-c1cnc2c(c1)[nH]c1ncccc21
Fc1cc(ccn1)-c1nc2[nH]c3ccncc3c2s1
Fc1cc2ccn(-c3cc4ccccc4cn3)c2cn1
Fc1ccc(cc1)-c1ccncc1NC(=O)c1ccnn2cc(nc12)C1=CCCCC1 |t:29|
Fc1ccc(cc1)-c1ccncc1NC(=O)c1ccnn2cc(nc12)C1CC1
Fc1ccc(cn1)-c1cc2[nH]c3ncccc3c2cn1
Fc1ccc(cn1)-c1ccc(nc1)-n1ccc2ccncc12
Fc1ccc(cn1)-c1ccc2c(n1)[nH]c1cnccc21
Fc1ccc(cn1)-c1ccc2c(n1)[nH]c1ncccc21
Fc1ccc(cn1)C(=O)Nc1ccc2c(n1)[nH]c1ccncc21
Fc1ccc(nc1)-c1ccc2c(n1)[nH]c1ccncc21
Fc1ccc2cnc(cc2c1)-n1ccc2ccncc12
Fc1ccc2cnc(cc2n1)-n1ccc2ccncc12
Fc1ccc2cnc(nc2c1)-n1ccc2ccncc12
Fc1ccc2nc(ncc2c1)-n1ccc2ccncc12
Fc1cccc(n1)-c1ccc(nc1)-n1ccc2ccncc12
Fc1cccc2cnc(cc12)-n1ccc2ccncc12
Fc1nc(ccc1-c1cccnc1)-n1ccc2ccncc12
Fc1nccc2cnc(cc12)-n1ccc2ccncc12
Fc1ncccc1-c1cc2[nH]c3ccncc3c2cn1
Fc1ncccc1-c1ccc2c(c1)[nH]c1ccncc21
Fc1ncccc1-c1ccc2c(n1)[nH]c1cccnc21
Fc1ncccc1-c1ccc2c(n1)[nH]c1ccncc21
Fc1ncccc1-c1ccc2c(n1)[nH]c1cnccc21
Fc1ncccc1-c1ccc2c(n1)[nH]c1ncccc21
Fc1ncccc1-c1cnc2c(c1)[nH]c1ccncc21
Ic1ccc2cnc(cc2c1)-n1ccc2ccncc12
N#C\[#6](=[#6]/c1ccc(s1)-c1ccc(-c2ccc(cc2)-[#7](-c2ccccc2)-c2ccccc2)c2nsnc12)C#N
N#C\[#6](=[#6]/c1ccc(s1)-c1ccc(s1)-c1ccc(cc1)-[#7](-c1ccccc1)-c1ccccc1)C#N
NC(=O)C(=C\c1ccc(s1)-c1ccc(-c2ccc(cc2)N(c2ccccc2)c2ccccc2)c2nsnc12)\C#N
NC(=O)C(=C\c1ccc(s1)-c1ccc(s1)-c1ccc(cc1)N(c1ccccc1)c1ccccc1)\C#N
Nc1c(F)ccc2cc(ncc12)-n1ccc2ccncc12
Nc1c(F)ccc2cnc(cc12)-n1ccc2ccncc12
Nc1c(I)ccc2cc(ncc12)-n1ccc2ccncc12
Nc1c(I)ccc2cnc(cc12)-n1ccc2ccncc12
Nc1cc(F)c2cc(ncc2c1)-n1ccc2ccncc12
Nc1cc(F)c2cnc(cc2c1)-n1ccc2ccncc12
Nc1cc(F)cc2cc(ncc12)-n1ccc2ccncc12
Nc1cc(F)cc2cnc(cc12)-n1ccc2ccncc12
Nc1cc(I)c2cc(ncc2c1)-n1ccc2ccncc12
Nc1cc(I)c2cnc(cc2c1)-n1ccc2ccncc12
Nc1cc(I)cc2cc(ncc12)-n1ccc2ccncc12
Nc1cc(I)cc2cnc(cc12)-n1ccc2ccncc12
Nc1cc(ccn1)-c1ccc(nc1)-n1ccc2ccncc12
Nc1cc(ccn1)-c1ccc2c(n1)[nH]c1ccncc21
Nc1cc(cnc1F)-c1ccc2c(n1)[nH]c1ccncc21
Nc1cc2cc(ncc2cc1F)-n1ccc2ccncc12
Nc1cc2cc(ncc2cc1I)-n1ccc2ccncc12
Nc1cc2cnc(cc2cc1F)-n1ccc2ccncc12
Nc1ccc(C=Cc2nc3ccc(I)cc3[nH]2)cc1 |w:6.6|
Nc1ccc(F)c2cc(ncc12)-n1ccc2ccncc12
Nc1ccc(F)c2cnc(cc12)-n1ccc2ccncc12
Nc1ccc(I)c2cc(ncc12)-n1ccc2ccncc12
Nc1ccc(I)c2cnc(cc12)-n1ccc2ccncc12
Nc1ccc(\C=C\C=C2/C(=O)Nc3ccccc23)cc1
Nc1ccc(cc1)-c1ccc2cc(OCC(O)CF)ccc2n1
Nc1ccc(cc1)-c1ccc2cc(OCCF)ccc2n1
Nc1ccc(cn1)-c1ccc(nc1)-n1ccc2ccncc12
Nc1ccc2cc(ncc2c1)-n1ccc2ccncc12
Nc1ccc2cc(ncc2c1F)-n1ccc2ccncc12
Nc1ccc2cc(ncc2c1I)-n1ccc2ccncc12
Nc1ccc2cnc(cc2c1F)-n1ccc2ccncc12
Nc1ccc2cnc(cc2c1I)-n1ccc2ccncc12
Nc1ccc2nc3ccc(=[NH2+])cc3sc2c1
Nc1cccc2cc(ncc12)-n1ccc2ccncc12
Nc1cccc2cnc(cc12)-n1ccc2cc(F)ncc12
Nc1cccc2cnc(cc12)-n1ccc2ccnc(F)c12
Nc1cccc2cnc(cc12)-n1ccc2ccncc12
Nc1nc(Nc2cccnc2)sc1C(=O)c1ccccc1F
Nc1ncc(cc1F)-c1ccc2c(n1)[nH]c1ccncc21
Nc1nccc2cnc(cc12)-n1ccc2ccncc12
O=C(Nc1cccnc1)c1ccnn2c(NCC3CC3)cnc12
O=C(Nc1cccnc1)c1ccnn2cc(nc12)-c1ccccc1
O=C(Nc1cnccc1-c1ccc(cc1)C#N)c1ccnn2cc(nc12)-c1ccccc1
O=C(Nc1cnccc1-c1ccccc1)c1ccnn2c(NCC3CC3)cnc12
O=C(Nc1cnccc1-c1ccccc1)c1ccnn2cc(nc12)-c1ccccc1
O=C(Nc1cnccc1N1CCCCC1)c1ccnn2ccnc12
O=C(Nc1cnccc1N1CCOCC1)c1ccnn2c(NCC3CC3)cnc12
O=C(Nc1cnccc1N1CCOCC1)c1ccnn2cc(nc12)-c1ccccc1
O=C1N(Cc2ccccc2)c2ccccc2\C1=C\C=C\c1ccccc1
O=C1Nc2ccccc2\C1=C\C=C\c1ccccc1
O=Cc1ccc(s1)-c1ccc(-c2ccc(cc2)N(c2ccccc2)c2ccccc2)c2nsnc12
O=Cc1ccc(s1)-c1ccc(s1)-c1ccc(cc1)N(c1ccccc1)c1ccccc1
O=Cc1ccc(s1)-c1ccc(s1)-c1ccc2[nH]ccc2c1
O=[#6]-1-[#7]-[#6](=O)\[#6](=[#6]/c2ccc(s2)-c2ccc(s2)-c2ccc(cc2)-[#7](-c2ccccc2)-c2ccccc2)-[#6](=O)-[#7]-1
OC(=O)C(=C\c1ccc(s1)-c1ccc(s1)-c1ccc(cc1)N(c1ccccc1)c1ccccc1)\C#N
OC1CCN(CC1)c1ccc(nc1)-n1ccc2ccncc12
OCCC1CCN(CC1)c1ccc(nc1)-n1ccc2ccncc12
Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c1cc(O)c(O)c(O)c1 |r|
Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O
Oc1cc(ccn1)-c1ccc2c(n1)[nH]c1ccncc21
Oc1ccc(Cc2cc(O)c(O)cc2O)cc1O
Oc1ccc(\C=C\C(=O)c2cc(O)c(O)cc2Br)cc1O
Oc1ccc(\C=C\C(=O)c2ccc(O)c(O)c2)cc1O
Oc1ccc(cc1O)-c1cc(Br)c(s1)-c1ccc(O)c(O)c1
Oc1ccc(cc1O)-c1cc(c(s1)-c1ccc(O)c(O)c1)-c1ccc(O)c(O)c1
Oc1ccc(cc1O)-c1ccc(-c2ccc(O)c(O)c2)c(c1)N(=O)=O
Oc1ccc(cc1O)-c1ccc(s1)-c1cc(O)c(O)c(O)c1
Oc1ccc(cc1O)-c1cn(nn1)-c1ccc(O)c(O)c1
Oc1ccc(cc1O)-c1cnc(o1)-c1ccc(O)c(O)c1
Oc1ccc(cc1O)-c1nc2cc(O)c(O)cc2o1
Oc1ccc(cc1O)-c1nnc(o1)-c1ccc(O)c(O)c1
Oc1ccc(cc1O)-c1nnc(s1)-c1ccc(O)c(O)c1
Oc1ccc(cc1O)-c1nsc(n1)-c1ccc(O)c(O)c1
Oc1ccc(cc1O)-c1oc2c(O)c(O)cc(O)c2c(=O)c1O
Oc1ccc(cc1O)C(=O)Nc1cc(O)c(O)cc1Br
Oc1ccc(cc1O)C(=O)\C=C\c1cc(O)c(O)cc1Br
Oc1ccc(cn1)-c1ccc2c(n1)[nH]c1ccncc21
Oc1ccc2cc(ncc2c1)-n1ccc2ccncc12
Oc1ccc2cnc(cc2c1)-n1ccc2ccncc12
Oc1ccc2nc(ncc2c1)-n1ccc2ccncc12
Oc1cccc2cc(ncc12)-n1ccc2ccncc12
Oc1cccc2cnc(cc12)-n1ccc2ccncc12
[#6]-[#7](-[#6]-[#6]F)-c1ccc2cc(ccc2c1)-[#6](\[#6])=[#6](\C#N)C#N
[#6]-[#7]-1-[#6](=O)-[#7](-[#6])-[#6](=O)\[#6](=[#6]/c2ccc(s2)-c2ccc(s2)-c2ccc(cc2)-[#7](-c2ccccc2)-c2ccccc2)-[#6]-1=O
[#6]-[#8]-c1ccc(cc1)-c1cc2n(c3cc(sc3c2s1)-c1ccc(\[#6]=[#6](/C#N)C#N)s1)C([#6])([#6])[#6]
[#6]-[#8]-c1ccc(cc1)-c1ccc(s1)-c1ccc(\[#6]=[#6](/C#N)C#N)s1
[#6]C([#6])([#6])n1c2cc(sc2c2sc(cc12)-c1ccc(cc1)-[#7](-c1ccccc1)-c1ccccc1)-c1ccc(\[#6]=[#6](/C#N)C#N)s1
[Cl-].CN(C)c1ccc2nc3ccc(N)cc3[s+]c2c1
[Cl-].CNc1ccc2nc3ccc(cc3[s+]c2c1)N(C)C
[O-][N+](=O)c1ccc(\C=C2/C(=O)N(Cc3ccccc3)c3ccccc23)cc1
[O-][N+](=O)c1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
[O-][N+](=O)c1ccc(\C=C2\C(=O)N(Cc3ccccc3)c3ccccc23)cc1
[O-][N+](=O)c1ccc(\C=C2\C(=O)Nc3ccccc23)cc1
[O-][N+](=O)c1ccc(\C=C\C=C2/C(=O)N(Cc3ccc(OCCF)cc3)c3ccccc23)cc1
[O-][N+](=O)c1ccc(\C=C\C=C2/C(=O)N(Cc3ccccc3)c3ccccc23)cc1
[O-][N+](=O)c1ccc(\C=C\C=C2/C(=O)Nc3ccccc23)cc1
[O-][N+](=O)c1ccc(\C=C\C=C2\C(=O)N(Cc3ccc(OCCF)cc3)c3ccccc23)cc1
[O-][N+](=O)c1ccc(\C=C\C=C2\C(=O)N(Cc3ccccc3)c3ccccc23)cc1
[O-][N+](=O)c1ccc(\C=C\C=C2\C(=O)Nc3ccccc23)cc1
c1cc([nH]n1)-c1ccc(nc1)-n1ccc2ccncc12
c1cc(ccn1)-c1ccc2c(n1)[nH]c1ccncc21
c1cc(co1)-c1ccc2c(n1)[nH]c1ccncc21
c1cc(nn1)-c1ccc2c(n1)[nH]c1ccncc21
c1cc2cc(ncc2[nH]1)-n1ccc2ccncc12
c1cc2ccncc2n1-c1cc2ccccc2cn1
c1cc2ccncc2n1-c1cc2cnccc2cn1
c1cc2ccncc2n1-c1ccc(cn1)-c1ccccn1
c1cc2ccncc2n1-c1ccc(cn1)-c1ccncn1
c1cc2ccncc2n1-c1ccc(cn1)-c1cnccn1
c1cncc(c1)-c1ccc2c(n1)[nH]c1ccncc21
c1n[nH]cc1-c1ccc2c(n1)[nH]c1ccncc21
c1n[nH]cc1-c1ccc2c(n1)[nH]c1cnccc21
c1nc(n[nH]1)-c1ccc(nc1)-n1ccc2ccncc12
c1ncc(s1)-c1ccc(nc1)-n1ccc2ccncc12