Drug_ID
string | Drug
string | Y
int64 |
|---|---|---|
2-[4-[3-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]propyl]piperazin-1-yl]pyrimidine
|
COc1cccc(CCc2ccccc2OCCCN2CCN(c3ncccn3)CC2)c1
| 1
|
2-[4-[4-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]butyl]piperazin-1-yl]pyrimidine
|
COc1cccc(CCc2ccccc2OCCCCN2CCN(c3ncccn3)CC2)c1
| 1
|
2-[4-[5-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]pentyl]piperazin-1-yl]pyrimidine
|
COc1cccc(CCc2ccccc2OCCCCCN2CCN(c3ncccn3)CC2)c1
| 1
|
1-[5-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]pentyl]-4-methylpiperazine
|
COc1cccc(CCc2ccccc2OCCCCCN2CCN(C)CC2)c1
| 1
|
(2S)-2-[2-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]ethyl]-3,4-dihydro-1H-isoquinoline
|
COc1cccc(CCc2ccccc2OCCN2CCc3ccccc3C2)c1
| 1
|
(2R)-2-[3-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]propyl]-3,4-dihydro-1H-isoquinoline
|
COc1cccc(CCc2ccccc2OCCCN2CCc3ccccc3C2)c1
| 1
|
(2R)-2-[5-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]pentyl]-3,4-dihydro-1H-isoquinoline
|
COc1cccc(CCc2ccccc2OCCCCCN2CCc3ccccc3C2)c1
| 1
|
(2S)-6,7-dimethoxy-2-[2-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]ethyl]-3,4-dihydro-1H-isoquinoline
|
COc1cccc(CCc2ccccc2OCCN2CCc3cc(OC)c(OC)cc3C2)c1
| 1
|
1-[4-[[(7R,8S,9S,10R,13R,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-yl]sulfanyl]phenyl]-3-[(1R)-1-phenylethyl]urea
|
CC(=O)[C@@H]1CC[C@@H]2[C@H]3[C@H](CC[C@@]12C)[C@@]1(C)CCC(=O)C=C1C[C@H]3Sc1ccc(NC(=O)N[C@H](C)c2ccccc2)cc1
| 1
|
ditert-butylbis(hydroxymethyl)-diphenylBLAHdicarboxylate
|
CC(C)(C)OC(=O)N1[C@H]2C3[C@H](c4ccccc4)C4(CO)[C@@H]1C1[C@H](c5ccccc5)C2(CO)[C@@H]3N(C(=O)OC(C)(C)C)[C@H]14
| 1
|
diphenylbis(hydroxymethyl)-diphenylBLAHdicarboxylate
|
O=C(Oc1ccccc1)N1[C@H]2C3[C@@H]4N(C(=O)Oc5ccccc5)[C@@H]5C([C@@H](c6ccccc6)C24CO)[C@H]1C5(CO)[C@@H]3c1ccccc1
| 1
|
[dibenzyl-(hydroxymethyl)-diphenylBLAHyl]methanol
|
OCC12[C@H](c3ccccc3)C3[C@@H]4N(Cc5ccccc5)[C@H]1C1[C@H]2N(Cc2ccccc2)[C@H]3C4(CO)[C@H]1c1ccccc1
| 1
|
Diclofenac
|
O=C(O)Cc1ccccc1Nc1c(Cl)cccc1Cl
| 0
|
Fluvoxamine
|
COCCCC/C(=N/OCCN)c1ccc(C(F)(F)F)cc1
| 0
|
Nortritpyline
|
CNCCC=C1c2ccccc2CCc2ccccc21
| 0
|
Nicardipine
|
COC(=O)C1=C(C)NC(C)=C(C(=O)OCCN(C)Cc2ccccc2)[C@@H]1c1cccc([N+](=O)[O-])c1
| 1
|
Amodiaquine
|
CCN(CC)Cc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1O
| 1
|
Caffeic acid
|
O=C(O)/C=C/c1ccc(O)c(O)c1
| 0
|
Famciclovir
|
CC(=O)OCC(CCn1cnc2cnc(N)nc21)COC(C)=O
| 0
|
Alfentanil
|
CCC(=O)N(c1ccccc1)C1(COC)CCN(CCn2nnn(CC)c2=O)CC1
| 0
|
Fentanyl
|
CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1
| 1
|
Tiapamil
|
COc1ccc(CCN(C)CCCC2(c3ccc(OC)c(OC)c3)S(=O)(=O)CCCS2(=O)=O)cc1OC
| 0
|
Apigenin
|
O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
| 0
|
Aztreonam
|
C[C@H]1[C@@H](NC(=O)/C(=N/OC(C)(C)C(=O)O)c2csc(N)n2)C(=O)N1S(=O)(=O)O
| 0
|
Catechin
|
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@@H](O)C2
| 0
|
Cefazolin
|
Cc1nnc(SCC2=C(C(=O)O)N3C(=O)[C@H](NC(=O)Cn4cnnn4)[C@H]3SC2)s1
| 0
|
Clebopride
|
COc1cc(N)c(Cl)cc1C(=O)NC1CCN(Cc2ccccc2)CC1
| 0
|
Dicumarol
|
O=c1c(Cc2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12
| 0
|
Dihydroergotamine
|
CN1C[C@@H](C(=O)NC2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21
| 1
|
Indapamide
|
C[C@H]1Nc2ccccc2[C@@H]1NC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1
| 0
|
N-benzyladenine
|
c1ccc(CNc2ncnc3nc[nH]c23)cc1
| 0
|
Nifuroxazide
|
O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
| 0
|
Norethindrone
|
C#C[C@]1(O)CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@H]4[C@H]3CC[C@]21C
| 0
|
Omadine
|
On1ccccc1=S
| 0
|
Oxymetazoline
|
Cc1cc(C(C)(C)C)c(O)c(C)c1CC1=NCCN1
| 1
|
Phenylpropanolamine
|
C[C@H](N)[C@H](O)c1ccccc1
| 0
|
Piperacillin
|
CCN1CCN(C(=O)N[C@@H](C(=O)NC2C(=O)N3[C@H]2SC(C)(C)[C@H]3C(=O)O)c2ccccc2)C(=O)C1=O
| 0
|
Resveratrol
|
Oc1ccc(/C=C/c2cc(O)cc(O)c2)cc1
| 0
|
Retrorsine
|
C/C=C1\C[C@@H](C)[C@](O)(CO)C(=O)OCC2=CCN3CC[C@H](OC1=O)C23
| 0
|
Sparteine
|
C1CCN2C[C@H]3C[C@@H](CN4CCCC[C@H]34)[C@H]2C1
| 0
|
Spironolactone
|
CC(=O)S[C@@H]1CC2=CC(=O)CC[C@@]2(C)[C@@H]2CC[C@@]3(C)[C@H](CC[C@]34CCC(=O)O4)[C@H]12
| 1
|
Triflusal
|
CC(=O)Oc1cc(C(F)(F)F)ccc1C(=O)O
| 0
|
Xylometazoline
|
Cc1cc(C(C)(C)C)cc(C)c1CC1=NCCN1
| 0
|
Zaprinast
|
CCCOc1ccccc1-c1nc2[nH][nH]nc-2c(=O)n1
| 0
|
4-[3,5-bis(trifluoromethyl)phenyl]aniline
|
Nc1ccc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1
| 1
|
S-mephenytoin
|
CC[C@@]1(c2ccccc2)NC(=O)N(C)C1=O
| 0
|
Fenvalerate
|
CC(C)[C@H](C(=O)O[C@H](C#N)c1cccc(Oc2ccccc2)c1)c1ccc(Cl)cc1
| 0
|
1-[4-[(2R)-2-hydroxy-3-quinolin-5-yloxypropyl]piperazin-1-yl]-2,2-diphenylethanone
|
O=C(C(c1ccccc1)c1ccccc1)N1CCN(C[C@H](O)COc2cccc3ncccc23)CC1
| 1
|
5-hydroxy-7-methoxy-2-phenyl-6-propoxychromen-4-one
|
CCCOc1c(OC)cc2oc(-c3ccccc3)cc(=O)c2c1O
| 1
|
1-[2-[(2S)-2-hydroxy-3-[4-(2-methylphenyl)piperazin-1-yl]propoxy]-5-methoxyphenyl]ethanone
|
COc1ccc(OC[C@@H](O)CN2CCN(c3ccccc3C)CC2)c(C(C)=O)c1
| 1
|
1-[5-acetyl-4-[(2S)-2-hydroxy-3-[4-(2-methylphenyl)piperazin-1-yl]propoxy]-2-methylphenyl]ethanone
|
CC(=O)c1cc(C(C)=O)c(OC[C@@H](O)CN2CCN(c3ccccc3C)CC2)cc1C
| 1
|
1-[3-[(2S)-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]-3-phenylpropan-1-one
|
Cc1cccc(N2CCN(C[C@H](O)COc3cccc(C(=O)CCc4ccccc4)c3)CC2)c1C
| 1
|
[2-[(2R)-3-(diethylamino)-2-hydroxypropoxy]phenyl]-phenylmethanone
|
CCN(CC)C[C@@H](O)COc1ccccc1C(=O)c1ccccc1
| 1
|
(1S)-2-[4-(3-methoxyphenyl)piperazin-1-yl]-1-(3-phenethyl-1-benzofuran-2-yl)ethanol
|
COc1cccc(N2CCN(C[C@H](O)c3oc4ccccc4c3CCc3ccccc3)CC2)c1
| 1
|
1-[2-[(2S)-3-(benzhydrylamino)-2-hydroxypropoxy]phenyl]-3-phenylpropan-1-one
|
O=C(CCc1ccccc1)c1ccccc1OC[C@@H](O)CNC(c1ccccc1)c1ccccc1
| 1
|
3-phenyl-1-[2-(7-piperidin-1-ylheptoxy)phenyl]propan-1-one
|
O=C(CCc1ccccc1)c1ccccc1OCCCCCCCN1CCCCC1
| 1
|
1-[2-[(2S)-2-hydroxy-3-piperidin-1-ylpropoxy]-5-phenoxyphenyl]-3-phenylpropan-1-one
|
O=C(CCc1ccccc1)c1cc(Oc2ccccc2)ccc1OC[C@@H](O)CN1CCCCC1
| 1
|
1-[2-[(2S)-3-anilino-2-hydroxypropoxy]phenyl]-3-phenylpropan-1-one
|
O=C(CCc1ccccc1)c1ccccc1OC[C@@H](O)CNc1ccccc1
| 1
|
1-[2-[(2R)-3-(4-benzylpiperazin-1-yl)-2-hydroxypropoxy]-5-phenoxyphenyl]-3-phenylpropan-1-one
|
O=C(CCc1ccccc1)c1cc(Oc2ccccc2)ccc1OC[C@H](O)CN1CCN(Cc2ccccc2)CC1
| 1
|
1-[2-[(2R)-2-hydroxy-3-[4-(2-methylphenyl)piperazin-1-yl]propoxy]phenyl]-3-(4-methylphenyl)propan-1-one
|
Cc1ccc(CCC(=O)c2ccccc2OC[C@H](O)CN2CCN(c3ccccc3C)CC2)cc1
| 1
|
(2S)-6,7-dimethoxy-2-[4-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]butyl]-3,4-dihydro-1H-isoquinoline
|
COc1cccc(CCc2ccccc2OCCCCN2CCc3cc(OC)c(OC)cc3C2)c1
| 1
|
(2R)-6,7-dimethoxy-2-[5-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]pentyl]-3,4-dihydro-1H-isoquinoline
|
COc1cccc(CCc2ccccc2OCCCCCN2CCc3cc(OC)c(OC)cc3C2)c1
| 1
|
1-[3-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]propyl]-4-methylpiperazine
|
COc1cccc(CCc2ccccc2OCCCN2CCN(C)CC2)c1
| 1
|
1-[4-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]butyl]-4-methylpiperazine
|
COc1cccc(CCc2ccccc2OCCCCN2CCN(C)CC2)c1
| 1
|
1-[4-[[(7R,8S,9S,10R,13S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-yl]sulfanyl]phenyl]-3-(2-chloroethyl)urea
|
CC(=O)[C@@H]1CC[C@@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CCC(=O)C=C1C[C@H]3Sc1ccc(NC(=O)NCCCl)cc1
| 1
|
1-[4-[[(7R,8S,9R,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-yl]sulfanyl]phenyl]-3-ethylurea
|
CCNC(=O)Nc1ccc(S[C@@H]2CC3=CC(=O)CC[C@]3(C)[C@@H]3CC[C@]4(C)[C@@H](C(C)=O)CC[C@@H]4[C@H]23)cc1
| 1
|
N-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-2-[(4-pentylbenzoyl)amino]benzamide
|
CCCCCc1ccc(C(=O)Nc2ccccc2C(=O)NCCN2CCc3cc(OC)c(OC)cc3C2)cc1
| 1
|
3-chloro-N-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-2-[(4-propan-2-ylbenzoyl)amino]benzamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1cccc(Cl)c1NC(=O)c1ccc(C(C)C)cc1)CC2
| 1
|
2-chloro-N-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-6-[(4-propan-2-ylbenzoyl)amino]benzamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1c(Cl)cccc1NC(=O)c1ccc(C(C)C)cc1)CC2
| 1
|
N-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-2-[(4-phenoxybenzoyl)amino]benzamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1ccccc1NC(=O)c1ccc(Oc3ccccc3)cc1)CC2
| 1
|
4-amino-N-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-2-[(4-propan-2-ylbenzoyl)amino]benzamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1ccc(N)cc1NC(=O)c1ccc(C(C)C)cc1)CC2
| 1
|
2-[(4-cyclohexyloxybenzoyl)amino]-N-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]benzamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1ccccc1NC(=O)c1ccc(OC3CCCCC3)cc1)CC2
| 1
|
N-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-2-[(4-phenylmethoxybenzoyl)amino]benzamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1ccccc1NC(=O)c1ccc(OCc3ccccc3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]naphthalene-1-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3cccc4ccccc34)cc1)CC2
| 1
|
N-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-2-[(4-phenylbenzoyl)amino]benzamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1ccccc1NC(=O)c1ccc(-c3ccccc3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]thiophene-2-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3cccs3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]thiophene-3-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3ccsc3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]furan-3-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3ccoc3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]-3,4-dimethylbenzamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3ccc(C)c(C)c3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]-1-benzofuran-2-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3cc4ccccc4o3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]quinoline-3-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3cnc4ccccc4c3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]quinoline-2-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3ccc4ccccc4n3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]-5-propanoylpyrazine-2-carboxamide
|
CCC(=O)c1cnc(C(=O)Nc2ccccc2C(=O)Nc2ccc(CCN3CCc4cc(OC)c(OC)cc4C3)cc2)cn1
| 1
|
N-[2-[[4-[[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]phenyl]carbamoyl]phenyl]quinoline-3-carboxamide
|
COc1cc2c(cc1OC)CN(Cc1ccc(NC(=O)c3ccccc3NC(=O)c3cnc4ccccc4c3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(3,4-dimethoxyphenyl)methyl-methylamino]ethyl]phenyl]carbamoyl]phenyl]quinoxaline-2-carboxamide
|
COc1ccc(CN(C)CCc2ccc(NC(=O)c3ccccc3NC(=O)c3cnc4ccccc4n3)cc2)cc1OC
| 1
|
2-[(4-cyclohexylbenzoyl)amino]-N-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]benzamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1ccccc1NC(=O)c1ccc(C3CCCCC3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(3,4-difluorophenyl)methyl-methylamino]ethyl]phenyl]carbamoyl]phenyl]quinoline-3-carboxamide
|
CN(CCc1ccc(NC(=O)c2ccccc2NC(=O)c2cnc3ccccc3c2)cc1)Cc1ccc(F)c(F)c1
| 1
|
N-[2-[[4-[2-[(4-hydroxy-3-methoxyphenyl)methyl-methylamino]ethyl]phenyl]carbamoyl]phenyl]quinoline-3-carboxamide
|
COc1cc(CN(C)CCc2ccc(NC(=O)c3ccccc3NC(=O)c3cnc4ccccc4c3)cc2)ccc1O
| 1
|
N-[2-[[3-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]-5-methylpyrazine-2-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1cccc(NC(=O)c3ccccc3NC(=O)c3cnc(C)cn3)c1)CC2
| 1
|
2-[(4-tert-butylbenzoyl)amino]-N-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]benzamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1ccccc1NC(=O)c1ccc(C(C)(C)C)cc1)CC2
| 1
|
5-chloro-N-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-2-[(4-propan-2-ylbenzoyl)amino]benzamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1cc(Cl)ccc1NC(=O)c1ccc(C(C)C)cc1)CC2
| 1
|
N-[2-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethylcarbamoyl]phenyl]isoquinoline-3-carboxamide
|
COc1cc2c(cc1OC)CN(CCNC(=O)c1ccccc1NC(=O)c1cc3ccccc3cn1)CC2
| 1
|
N-[2-[(2R)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-2-[(4-propylbenzoyl)amino]benzamide
|
CCCc1ccc(C(=O)Nc2ccccc2C(=O)NCCN2CCc3cc(OC)c(OC)cc3C2)cc1
| 1
|
N-[2-[[4-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]pyridine-2-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3ccccn3)cc1)CC2
| 1
|
N-[2-[[4-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]pyrazine-2-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3cnccn3)cc1)CC2
| 1
|
N-[4-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]-2-[(3-methoxybenzoyl)amino]benzamide
|
COc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(CCN3CCc4cc(OC)c(OC)cc4C3)cc2)c1
| 1
|
N-[2-[[4-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]ethyl]phenyl]carbamoyl]phenyl]quinoline-3-carboxamide
|
COc1ccc(CCN(C)CCc2ccc(NC(=O)c3ccccc3NC(=O)c3cnc4ccccc4c3)cc2)cc1OC
| 1
|
N-[2-[[4-[2-[(2S)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]phenyl]carbamoyl]phenyl]-2-methyl-1,3-thiazole-4-carboxamide
|
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3ccccc3NC(=O)c3csc(C)n3)cc1)CC2
| 1
|
N-(9-Cyano-5,6,7,8-tetrahydro-1,3,4b-triazafluoren-4-yl)-C-phenethylmethansulfonamide
|
N#Cc1c2n(c3c(NS(=O)(=O)Cc4ccccc4)ncnc13)CCCC2
| 1
|
4-{4-[2-(1H-Indol-3-yl)ethyl]piperazin-1-yl}-5,6,7,8-tetrahydro-1,3,4b-triazafluorene-9-carbonitrile
|
N#Cc1c2n(c3c(N4CCN(CCc5c[nH]c6ccccc56)CC4)ncnc13)CCCC2
| 1
|
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.