id stringlengths 36 36 | solution stringclasses 2
values | drug stringlengths 9 188 | problem stringlengths 59 245 |
|---|---|---|---|
cbf86108-ee63-453d-8220-8b63c1a4ca4c | Yes | N#Cc1ccc(Cn2cncc2C[NH2+][C@H]2CCN(c3ccncc3)C2=O)cc1 | Verify if this drug has hERG blocking properties. N#Cc1ccc(Cn2cncc2C[NH2+][C@H]2CCN(c3ccncc3)C2=O)cc1 |
fb7a2ab3-5e4e-4d7e-ab93-13e83dbad201 | Yes | Cc1nc[nH]c1CN1CCc2c(c3ccccc3n2C)C1=O | Is the drug in question known to block hERG channels? Cc1nc[nH]c1CN1CCc2c(c3ccccc3n2C)C1=O |
2e28345b-0017-441e-b774-f6a342453c8c | Yes | CN(C)CCCN1c2ccccc2CCc2ccccc21 | Is the drug provided capable of blocking hERG channels? CN(C)CCCN1c2ccccc2CCc2ccccc21 |
3cb88d8e-a8cc-4e50-9757-244858072944 | Yes | N[C@@H](C(=O)N1CC(c2cc(F)ccc2F)=C[C@H]1c1ccccc1)C1CC1 | Does the drug listed below function as a hERG inhibitor? N[C@@H](C(=O)N1CC(c2cc(F)ccc2F)=C[C@H]1c1ccccc1)C1CC1 |
8f4871a2-564a-4cad-a78c-6730aa36bfda | Yes | CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12 | Is the drug provided capable of blocking hERG channels? CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12 |
aa3012ae-a012-40e2-b352-a1dc6d743900 | Yes | CN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1 | Is the drug provided capable of blocking hERG channels? CN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1 |
285ab617-be3f-4a2c-a696-e79411deb6d4 | Yes | O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2ccc(OC(F)F)cc2o1 | Is the drug provided capable of blocking hERG channels? O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2ccc(OC(F)F)cc2o1 |
736a974d-641f-42c5-90b4-de81d63418b0 | Yes | O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2ccc(Cl)cc2o1 | Is this pharmaceutical compound a blocker of the hERG ion channel? O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2ccc(Cl)cc2o1 |
40f8eccb-587f-49d1-b2af-9598780d049b | Yes | Cn1nc(C(=O)NC2C[C@@H]3CCC[C@H](C2)[NH+]3C)c2ccccc21 | Is this pharmaceutical compound a blocker of the hERG ion channel? Cn1nc(C(=O)NC2C[C@@H]3CCC[C@H](C2)[NH+]3C)c2ccccc21 |
e7f245e9-566b-4ad9-8cf5-2760f5369214 | Yes | COCCCC/C(=N\OCC[NH3+])c1ccc(C(F)(F)F)cc1 | Check whether the given drug blocks hERG channels. COCCCC/C(=N\OCC[NH3+])c1ccc(C(F)(F)F)cc1 |
709a5d38-8d7e-4515-8d36-23210582da35 | Yes | O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2ncccn2)CC1 | Does this drug act as a hERG channel blocker? O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2ncccn2)CC1 |
0593ff98-2c3c-4750-8510-000c7d11af82 | Yes | O=C1CN(CCc2ccc(F)cc2)CCN1[C@H]1CCc2cc(Cn3ccnc3)ccc2C1 | Check whether the given drug blocks hERG channels. O=C1CN(CCc2ccc(F)cc2)CCN1[C@H]1CCc2cc(Cn3ccnc3)ccc2C1 |
80f37147-4460-4750-9d6a-4151e0053694 | Yes | O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2cc(F)ccc2o1 | Assess if the following substance is a hERG blocker. O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2cc(F)ccc2o1 |
115bdfc2-a85a-4d57-ad67-921286966bd8 | Yes | Clc1ccc2c(c1)N=C(N1CCNCC1)c1ccccc1N2 | Is the drug provided capable of blocking hERG channels? Clc1ccc2c(c1)N=C(N1CCNCC1)c1ccccc1N2 |
c121f51e-4a8c-4453-9060-525acfeabc38 | Yes | COCCC[NH+]1CCC(NC(=O)c2cc(Cl)c(N)c3c2OCC3)CC1 | Is the drug in question known to block hERG channels? COCCC[NH+]1CCC(NC(=O)c2cc(Cl)c(N)c3c2OCC3)CC1 |
322d3ca9-2375-4fb1-bd38-817da83ea97e | Yes | Cc1ccc(-c2nc(NC(=O)CC3CCN(C)CC3)cc(-n3nccc3C)n2)o1 | Is the drug in question known to block hERG channels? Cc1ccc(-c2nc(NC(=O)CC3CCN(C)CC3)cc(-n3nccc3C)n2)o1 |
9d916981-5324-404c-a9b1-d87a0a60ee31 | Yes | CC(C)(O)C(Cl)(Cl)Cl | Verify if this drug has hERG blocking properties. CC(C)(O)C(Cl)(Cl)Cl |
844e6d2e-077c-46ed-a9ac-43105dd6bb89 | Yes | Clc1ccc2c(c1)CCc1cccnc1C2=C1CC[NH2+]CC1 | Does the specified drug exhibit hERG blocking activity? Clc1ccc2c(c1)CCc1cccnc1C2=C1CC[NH2+]CC1 |
d85ab4ba-6804-49f0-b8e0-752012e249ac | Yes | COc1cc(-n2cnc3cc(-c4ccc(Cl)cc4)sc3c2=O)ccc1N1CC[C@H](O)C1 | Is the drug in question known to block hERG channels? COc1cc(-n2cnc3cc(-c4ccc(Cl)cc4)sc3c2=O)ccc1N1CC[C@H](O)C1 |
36dc2f6c-b963-41a7-a842-a80ef611929a | Yes | Clc1ccc2c(c1)N=C(N1CC[NH2+]CC1)c1ccccc1N2 | Is this pharmaceutical compound a blocker of the hERG ion channel? Clc1ccc2c(c1)N=C(N1CC[NH2+]CC1)c1ccccc1N2 |
d6831763-8fe9-454b-a5c3-b8d341b8a1a6 | Yes | C[C@@H](O)c1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12 | Check whether the given drug blocks hERG channels. C[C@@H](O)c1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12 |
dc90f55e-2041-4300-973a-b7d537459c97 | Yes | c1ccc(-c2[nH]c3ccccc3c2[C@H]2CCC[NH2+]C2)cc1 | Assess if the following substance is a hERG blocker. c1ccc(-c2[nH]c3ccccc3c2[C@H]2CCC[NH2+]C2)cc1 |
349ace5b-0332-42f1-87ad-85175d3bdaca | Yes | Clc1ccc2c(c1)C(N1CCNCC1)=Nc1ccccc1O2 | Does the specified drug exhibit hERG blocking activity? Clc1ccc2c(c1)C(N1CCNCC1)=Nc1ccccc1O2 |
3921119a-841c-433b-b8e2-d2d69fb60a8b | Yes | COc1ccc2c(c1)[C@]13CCCC[C@@H]1[C@H](C2)N(C)CC3 | Is this pharmaceutical compound a blocker of the hERG ion channel? COc1ccc2c(c1)[C@]13CCCC[C@@H]1[C@H](C2)N(C)CC3 |
5b7a08e6-76ed-4dfe-9806-bd72aae14661 | Yes | COc1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1 | Does the specified drug exhibit hERG blocking activity? COc1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1 |
0d7411fe-8ddc-459f-9a05-c22242ffb39f | Yes | Fc1ccc2c([C@@H]3C[NH2+]CC[C@@H]3F)c(C3CCCCCC3)[nH]c2c1 | Verify if this drug has hERG blocking properties. Fc1ccc2c([C@@H]3C[NH2+]CC[C@@H]3F)c(C3CCCCCC3)[nH]c2c1 |
292dda54-6f50-4225-b970-2aac63870d85 | Yes | CN(C)CCC=C1c2ccccc2CCc2ccccc21 | Check whether the given drug blocks hERG channels. CN(C)CCC=C1c2ccccc2CCc2ccccc21 |
35ffe5d0-dd5f-43ef-8600-213dede7c571 | Yes | CN(C)C[C@@H](c1ccc(O)cc1)C1(O)CCCCC1 | Determine if the following medication inhibits hERG potassium channels. CN(C)C[C@@H](c1ccc(O)cc1)C1(O)CCCCC1 |
afb75d51-343a-4b7b-a4ba-a2e6513be15c | Yes | O=C(NC1CCN(Cc2ccc3c(c2)OC(F)(F)O3)CC1)c1cc(=O)c2ccc(F)cc2o1 | Assess if the following substance is a hERG blocker. O=C(NC1CCN(Cc2ccc3c(c2)OC(F)(F)O3)CC1)c1cc(=O)c2ccc(F)cc2o1 |
c10b45e5-c5b4-4a66-88e7-56301901db87 | Yes | c1ccc(-c2[nH]c3ccccc3c2C2CC[NH2+]CC2)cc1 | Determine if the following medication inhibits hERG potassium channels. c1ccc(-c2[nH]c3ccccc3c2C2CC[NH2+]CC2)cc1 |
588ec353-a280-4298-8002-ce56d876d38c | Yes | O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1 | Does the specified drug exhibit hERG blocking activity? O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1 |
75770081-21e3-4006-bb76-42c02e2f50b1 | Yes | N#Cc1ccc(Cn2cncc2C[NH2+][C@@H]2CCN(C(=O)c3cncc(Br)c3)C2=O)cc1 | Determine if the following medication inhibits hERG potassium channels. N#Cc1ccc(Cn2cncc2C[NH2+][C@@H]2CCN(C(=O)c3cncc(Br)c3)C2=O)cc1 |
8a5c8b6c-5f2e-41f8-a154-0915c4bc73a3 | Yes | O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2cc(Cl)c(Cl)cc2o1 | Does the specified drug exhibit hERG blocking activity? O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2cc(Cl)c(Cl)cc2o1 |
29c1b24d-84b9-4ccb-ad15-5f07dfe80bcc | Yes | Fc1ccc(-n2cc(C3CC[NH+](CCN4CCNC4=S)CC3)c3cc(Cl)ccc32)cc1 | Verify if this drug has hERG blocking properties. Fc1ccc(-n2cc(C3CC[NH+](CCN4CCNC4=S)CC3)c3cc(Cl)ccc32)cc1 |
4814cb00-8d1c-4512-9e56-c4d6ec7bfff3 | Yes | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | Verify if this drug has hERG blocking properties. CNCC[C@@H](Oc1ccccc1C)c1ccccc1 |
8cca2f2a-1146-40c4-b791-9cd7a9cf7d96 | Yes | CN(C(=O)N1CC(c2cc(F)ccc2F)=C[C@H]1c1cccc(O)c1)C1CCNCC1 | Does the specified drug exhibit hERG blocking activity? CN(C(=O)N1CC(c2cc(F)ccc2F)=C[C@H]1c1cccc(O)c1)C1CCNCC1 |
163b441e-d6f6-4671-a8bb-5a272a547f42 | Yes | CCS(=O)(=O)C[NH2+][C@@H]1c2cc(C[NH3+])ccc2OC(C)(C)[C@H]1O | Does the specified drug exhibit hERG blocking activity? CCS(=O)(=O)C[NH2+][C@@H]1c2cc(C[NH3+])ccc2OC(C)(C)[C@H]1O |
89e08b8d-5500-4584-8873-d381a1386781 | Yes | C[NH+]1CCCC[C@@H]1c1c(-c2ccccc2)[nH]c2ccccc12 | Is this pharmaceutical compound a blocker of the hERG ion channel? C[NH+]1CCCC[C@@H]1c1c(-c2ccccc2)[nH]c2ccccc12 |
826232f9-6de5-4891-93c1-92de71790af8 | Yes | Fc1ccc2[nH]c(-c3ccccc3)c([C@@H]3C[NH2+]CC[C@@H]3F)c2c1 | Verify if this drug has hERG blocking properties. Fc1ccc2[nH]c(-c3ccccc3)c([C@@H]3C[NH2+]CC[C@@H]3F)c2c1 |
fb291f4a-917c-4b93-9509-7b1e021dbd90 | Yes | COC(=O)[C@H]1[C@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1[NH+]2C | Is the drug provided capable of blocking hERG channels? COC(=O)[C@H]1[C@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1[NH+]2C |
e506f346-db04-4d90-9d56-6e061e14650a | Yes | N#Cc1ccc(Cn2cncc2C[NH2+][C@H]2CCN(Cc3ccccc3)C2=O)cc1 | Determine if the following medication inhibits hERG potassium channels. N#Cc1ccc(Cn2cncc2C[NH2+][C@H]2CCN(Cc3ccccc3)C2=O)cc1 |
15d2e093-47c7-4309-a15e-c1e96a80d952 | Yes | CC(C)N(CC[C@@](C(N)=O)(c1ccccc1)c1ccccn1)C(C)C | Does the specified drug exhibit hERG blocking activity? CC(C)N(CC[C@@](C(N)=O)(c1ccccc1)c1ccccn1)C(C)C |
0d9f1a30-8b48-48a4-9ad8-546f8796f93b | Yes | COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC | Assess if the following substance is a hERG blocker. COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC |
35db3560-9817-4842-b49b-c08a8971abae | Yes | COc1ccc(C[C@@H]2c3cc(Oc4cc(C[C@@H]5c6cc(OC)c(OC)cc6CCN5C)ccc4O)c(OC)cc3CCN2C)cc1 | Determine if the following medication inhibits hERG potassium channels. COc1ccc(C[C@@H]2c3cc(Oc4cc(C[C@@H]5c6cc(OC)c(OC)cc6CCN5C)ccc4O)c(OC)cc3CCN2C)cc1 |
0d94b3cd-f9f5-4297-9f97-d0ce13a59dfa | Yes | CO[C@]12CC[C@@]3(C[C@@H]1[C@@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CC[NH+]1CC1CC1)[C@H]2O5 | Is the drug provided capable of blocking hERG channels? CO[C@]12CC[C@@]3(C[C@@H]1[C@@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CC[NH+]1CC1CC1)[C@H]2O5 |
48dd0e4c-3c2e-4bf8-82ca-cd2ff4517fa2 | Yes | CSc1ncccc1C(=O)N1CC[C@@H]([NH2+]Cc2cncn2Cc2ccc(C#N)cc2)C1=O | Is this pharmaceutical compound a blocker of the hERG ion channel? CSc1ncccc1C(=O)N1CC[C@@H]([NH2+]Cc2cncn2Cc2ccc(C#N)cc2)C1=O |
f13516f8-ced5-4b49-8617-816f5b924d48 | Yes | C[NH2+][C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | Is the drug provided capable of blocking hERG channels? C[NH2+][C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 |
d746619b-f758-426b-8d12-400d7d9f20c3 | Yes | CCCC[NH+](CCCC)C[C@H](O)c1cc(Cl)cc2c1-c1ccc(Cl)cc1/C2=C\c1ccc(Cl)cc1 | Does this drug act as a hERG channel blocker? CCCC[NH+](CCCC)C[C@H](O)c1cc(Cl)cc2c1-c1ccc(Cl)cc1/C2=C\c1ccc(Cl)cc1 |
3b8ee971-4dd5-4be4-9f79-7ce86a6e8da0 | Yes | CC(C)c1nc(CN(C)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)OCc2cncs2)C(C)C)cs1 | Is the drug in question known to block hERG channels? CC(C)c1nc(CN(C)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)OCc2cncs2)C(C)C)cs1 |
67d93962-dced-49c2-a18d-d7c5b2800095 | Yes | COC(=O)c1[nH]c2cc(F)ccc2c1[C@@H]1C[NH2+]CC[C@H]1F | Is the drug provided capable of blocking hERG channels? COC(=O)c1[nH]c2cc(F)ccc2c1[C@@H]1C[NH2+]CC[C@H]1F |
3ccf802b-ad75-4f92-a38b-6587fda7fb0a | Yes | CC(C)[C@H](N)C(=O)N1CC(c2cc(F)ccc2F)=C[C@@H]1c1cccc(O)c1 | Assess if the following substance is a hERG blocker. CC(C)[C@H](N)C(=O)N1CC(c2cc(F)ccc2F)=C[C@@H]1c1cccc(O)c1 |
0e300e60-fdcc-49e3-844b-5cda6f59d550 | Yes | COc1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1F | Determine if the following medication inhibits hERG potassium channels. COc1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1F |
72361ffd-01c6-4391-b14d-21cfdecca438 | Yes | Cc1cccc(C)c1OCC(=O)N[C@H](Cc1ccccc1)[C@H](O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H](C(C)C)N1CCCNC1=O | Does the drug listed below function as a hERG inhibitor? Cc1cccc(C)c1OCC(=O)N[C@H](Cc1ccccc1)[C@H](O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H](C(C)C)N1CCCNC1=O |
654032a5-2c10-4aa6-aae6-f7f76c62fc98 | Yes | Cc1ccc(OC[C@H](O)[C@H](C)NC(C)C)c2c1CCC2 | Does this drug act as a hERG channel blocker? Cc1ccc(OC[C@H](O)[C@H](C)NC(C)C)c2c1CCC2 |
13b1d590-4350-4c6e-80c6-0e7502280071 | Yes | C[NH+]1CCC[C@H](c2c(-c3ccccc3)[nH]c3ccccc23)C1 | Does this drug act as a hERG channel blocker? C[NH+]1CCC[C@H](c2c(-c3ccccc3)[nH]c3ccccc23)C1 |
f7ec0cd1-a551-4efa-8ac8-d90df4761427 | Yes | NC(N)=[NH+]c1nc(CSCC/C(N)=[NH+]/S(N)(=O)=O)cs1 | Determine if the following medication inhibits hERG potassium channels. NC(N)=[NH+]c1nc(CSCC/C(N)=[NH+]/S(N)(=O)=O)cs1 |
89cfd999-e8ea-4ed4-a528-d0395a2f8ce6 | Yes | CN([C@@H]1c2cc(OCCCC(F)(F)F)ccc2OC(C)(C)[C@H]1O)S(C)(=O)=O | Does this drug act as a hERG channel blocker? CN([C@@H]1c2cc(OCCCC(F)(F)F)ccc2OC(C)(C)[C@H]1O)S(C)(=O)=O |
ae341bbf-3b85-46dd-904f-e58a6c342d15 | Yes | CC(C)Cn1c(=O)n(C)c(=O)c2[nH]cnc21 | Does the specified drug exhibit hERG blocking activity? CC(C)Cn1c(=O)n(C)c(=O)c2[nH]cnc21 |
0f7dc21e-dae1-4c57-8747-cbabed19a8d4 | Yes | Cc1cccc(C)c1OC[C@@H](C)[NH3+] | Does the specified drug exhibit hERG blocking activity? Cc1cccc(C)c1OC[C@@H](C)[NH3+] |
0182c967-eb5b-4ca1-8a1c-dfc393db4cd8 | Yes | CN(C(=O)Cc1ccc(CNS(C)(=O)=O)cc1)[C@@H](CN1CC[C@@H](O)C1)c1ccccc1 | Does this drug act as a hERG channel blocker? CN(C(=O)Cc1ccc(CNS(C)(=O)=O)cc1)[C@@H](CN1CC[C@@H](O)C1)c1ccccc1 |
c4e5ea93-0239-41c4-bf3b-e1ba57f31f11 | Yes | O=C1NCCN1CC[NH+]1CC=C(c2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)CC1 | Does the specified drug exhibit hERG blocking activity? O=C1NCCN1CC[NH+]1CC=C(c2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)CC1 |
c610c878-f9ba-4862-8139-2437e2d2cfe3 | Yes | Cc1ncccc1C(=O)N1CC[C@H]([NH2+]Cc2cncn2Cc2ccc(C#N)cc2)C1=O | Is this pharmaceutical compound a blocker of the hERG ion channel? Cc1ncccc1C(=O)N1CC[C@H]([NH2+]Cc2cncn2Cc2ccc(C#N)cc2)C1=O |
29b35fe8-f683-44e1-8807-985967bd4821 | Yes | COc1cc2c(Oc3ccc4[nH]c(C)c(C)c4c3)ncnc2cc1OCCN1CCN(CC(C)=O)CC1 | Assess if the following substance is a hERG blocker. COc1cc2c(Oc3ccc4[nH]c(C)c(C)c4c3)ncnc2cc1OCCN1CCN(CC(C)=O)CC1 |
fe6cb8ea-d8a7-46e0-96f0-e8fe871476c4 | Yes | CC(C)(C)N1CCC(c2ccccc2)(c2ccccc2)CC1 | Does this drug act as a hERG channel blocker? CC(C)(C)N1CCC(c2ccccc2)(c2ccccc2)CC1 |
e653620b-863b-4203-a962-231ec5741b99 | Yes | COc1cccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)c1 | Determine if the following medication inhibits hERG potassium channels. COc1cccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)c1 |
9a7d9f48-9ff7-46bf-9938-97b5768db662 | Yes | O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2cc(F)c(Cl)cc2o1 | Does the specified drug exhibit hERG blocking activity? O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2cc(F)c(Cl)cc2o1 |
ce4a7dad-b2fe-4fa5-a62c-64e517161688 | Yes | O=C1CN(CCc2ccc(F)cc2)CCN1[C@H]1CCc2cc(CN3CCCCC3)ccc2C1 | Does the drug listed below function as a hERG inhibitor? O=C1CN(CCc2ccc(F)cc2)CCN1[C@H]1CCc2cc(CN3CCCCC3)ccc2C1 |
87051d75-db21-4fa4-a3d1-c7faf81cec82 | Yes | COc1ccc2c(=O)cc(C(=O)NC3CCN(Cc4ccc5c(c4)OCO5)CC3)oc2c1 | Is the drug provided capable of blocking hERG channels? COc1ccc2c(=O)cc(C(=O)NC3CCN(Cc4ccc5c(c4)OCO5)CC3)oc2c1 |
d6bb93f1-b74d-48a0-8b67-549522a4fce7 | Yes | COCCOCC#Cc1cc(-c2n[nH]c3c2Cc2ccc(Cn4cncn4)cc2-3)cs1 | Does this drug act as a hERG channel blocker? COCCOCC#Cc1cc(-c2n[nH]c3c2Cc2ccc(Cn4cncn4)cc2-3)cs1 |
ad0271ba-e7df-43c8-aff7-9c98ba0545c3 | Yes | CC[C@@H](O)C(C[C@@H](C)NC)(c1ccccc1)c1ccccc1 | Does the specified drug exhibit hERG blocking activity? CC[C@@H](O)C(C[C@@H](C)NC)(c1ccccc1)c1ccccc1 |
0dad9b0b-acb1-4b99-84d4-c3553e5e2ebc | Yes | O=C(NC1CCN(Cc2ccc3c(c2)OCCO3)CC1)c1cc(=O)c2ccc(F)cc2o1 | Does this drug act as a hERG channel blocker? O=C(NC1CCN(Cc2ccc3c(c2)OCCO3)CC1)c1cc(=O)c2ccc(F)cc2o1 |
e0790341-2b5c-42bf-9cdb-d986a5c8dca1 | Yes | COc1ccc(CCNCCCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC | Is the drug in question known to block hERG channels? COc1ccc(CCNCCCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC |
3eb821df-e3f0-4418-b1bb-34f412852361 | Yes | CC[C@@H](C)C(=O)O[C@@H]1C[C@@H](C)C=C2C=C[C@@H](C)[C@@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]21 | Is this pharmaceutical compound a blocker of the hERG ion channel? CC[C@@H](C)C(=O)O[C@@H]1C[C@@H](C)C=C2C=C[C@@H](C)[C@@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]21 |
d3f184b9-a3ef-4de9-9f24-982c90fc13b4 | Yes | CCCc1nc(C)c2c(=O)nc(-c3cc(S(=O)(=O)N4CC[NH+](CC)CC4)ccc3OCC)[nH]n12 | Does this drug act as a hERG channel blocker? CCCc1nc(C)c2c(=O)nc(-c3cc(S(=O)(=O)N4CC[NH+](CC)CC4)ccc3OCC)[nH]n12 |
094f959d-d55a-4348-93a4-45a59fb9c6bd | Yes | CS(=O)(=O)N1CCN(Cc2ccc3c(c2)CC[C@H](N2CCN(CCc4ccc(F)cc4)CC2=O)C3)CC1 | Is the drug provided capable of blocking hERG channels? CS(=O)(=O)N1CCN(Cc2ccc3c(c2)CC[C@H](N2CCN(CCc4ccc(F)cc4)CC2=O)C3)CC1 |
b62e7ef7-046c-4966-a9e9-d2667fe4eb5e | Yes | Cc1cn2ccn(CC3(c4ccc(C(F)(F)F)cc4)CC3)c(=O)c2n1 | Determine if the following medication inhibits hERG potassium channels. Cc1cn2ccn(CC3(c4ccc(C(F)(F)F)cc4)CC3)c(=O)c2n1 |
2b1a53e3-2756-4c47-81bc-c0e4499f4383 | Yes | Cc1cc2c(s1)Nc1ccccc1N=C2N1CCNCC1 | Is the drug provided capable of blocking hERG channels? Cc1cc2c(s1)Nc1ccccc1N=C2N1CCNCC1 |
069279a9-7705-45ff-a550-276008b73d8d | Yes | CCSc1ncccc1C(=O)N1CC[C@@H]([NH2+]Cc2cncn2Cc2ccc(C#N)cc2)C1=O | Does this drug act as a hERG channel blocker? CCSc1ncccc1C(=O)N1CC[C@@H]([NH2+]Cc2cncn2Cc2ccc(C#N)cc2)C1=O |
bfe20f69-0108-46eb-a963-9688f1466da8 | Yes | COc1ccccc1OC[C@H](O)C[NH+]1CC[NH+](CC(=O)Nc2c(C)cccc2C)CC1 | Verify if this drug has hERG blocking properties. COc1ccccc1OC[C@H](O)C[NH+]1CC[NH+](CC(=O)Nc2c(C)cccc2C)CC1 |
f558a735-80d2-454c-a029-c96e17beec85 | Yes | CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2C[NH+]1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc2ccccc2n1 | Check whether the given drug blocks hERG channels. CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2C[NH+]1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc2ccccc2n1 |
e07bf4d3-2e48-45e5-9d39-86d0baeaffaa | Yes | CCC(O)(CC)c1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12 | Check whether the given drug blocks hERG channels. CCC(O)(CC)c1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12 |
ff53546c-46d9-4399-a530-c564715ad8ed | Yes | CC(C)C[C@@H]([NH+](C)C)C1(c2ccc(Cl)cc2)CCC1 | Assess if the following substance is a hERG blocker. CC(C)C[C@@H]([NH+](C)C)C1(c2ccc(Cl)cc2)CCC1 |
f805445e-6421-425d-8507-ffdedd79df20 | Yes | COc1cc2oc(C(=O)NC3CCN(Cc4ccc5c(c4)OCO5)CC3)cc(=O)c2cc1F | Determine if the following medication inhibits hERG potassium channels. COc1cc2oc(C(=O)NC3CCN(Cc4ccc5c(c4)OCO5)CC3)cc(=O)c2cc1F |
c14c5c88-b848-4cce-b4bd-d7f29ab8bd8c | Yes | COc1cc2nc(N3CCN(C(=O)[C@@H]4CCCO4)CC3)nc(N)c2cc1OC | Check whether the given drug blocks hERG channels. COc1cc2nc(N3CCN(C(=O)[C@@H]4CCCO4)CC3)nc(N)c2cc1OC |
8e20a753-a854-42d4-89c8-7f005b49a894 | Yes | COc1ccc([C@@H]2Sc3ccccc3N(CC[NH+](C)C)C(=O)[C@@H]2OC(C)=O)cc1 | Is the drug in question known to block hERG channels? COc1ccc([C@@H]2Sc3ccccc3N(CC[NH+](C)C)C(=O)[C@@H]2OC(C)=O)cc1 |
fb4827d2-e561-444a-829c-c31e0f5c4584 | Yes | CC(C)(C(=O)O)c1ccc([C@H](O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | Is the drug in question known to block hERG channels? CC(C)(C(=O)O)c1ccc([C@H](O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 |
96c2324e-736f-426b-a211-0ac57f7c0b36 | Yes | O=C([C@@H](O)C1CC1)N1CC(c2cc(F)ccc2F)=C[C@H]1c1cccc(O)c1 | Determine if the following medication inhibits hERG potassium channels. O=C([C@@H](O)C1CC1)N1CC(c2cc(F)ccc2F)=C[C@H]1c1cccc(O)c1 |
fbe19610-e176-4a80-bfaa-0700c07d762c | Yes | C[C@H]1CN(c2c(F)c(N)c3c(c2F)[N+](C2CC2)=C[C@@H](C(=O)[O-])C3=O)C[C@@H](C)[NH2+]1 | Is this pharmaceutical compound a blocker of the hERG ion channel? C[C@H]1CN(c2c(F)c(N)c3c(c2F)[N+](C2CC2)=C[C@@H](C(=O)[O-])C3=O)C[C@@H](C)[NH2+]1 |
957732d5-096e-4408-b683-af89e8fd2254 | Yes | CN(C)CCOC(c1ccccc1)c1ccccc1 | Check whether the given drug blocks hERG channels. CN(C)CCOC(c1ccccc1)c1ccccc1 |
8dd4b905-dd71-456a-b760-f780982e9c95 | Yes | CCS(=O)(=O)N(C)[C@H]1c2cc(C#N)ccc2OC(C)(C)[C@@H]1O | Is the drug in question known to block hERG channels? CCS(=O)(=O)N(C)[C@H]1c2cc(C#N)ccc2OC(C)(C)[C@@H]1O |
7417d61d-413b-49d2-9338-7062193bfc17 | Yes | CN(CCCN1c2ccccc2CCc2ccccc21)C(=O)c1cc2cc(Cl)ccc2o1 | Does this drug act as a hERG channel blocker? CN(CCCN1c2ccccc2CCc2ccccc21)C(=O)c1cc2cc(Cl)ccc2o1 |
b9d51b98-f678-4353-8249-05938a1eaac2 | Yes | CC(=O)c1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1 | Check whether the given drug blocks hERG channels. CC(=O)c1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1 |
5b57acb6-89c6-4f13-86cb-8b0e3c4d9efa | Yes | CCCOC(C(=O)OC1CCN(C)CC1)(c1ccccc1)c1ccccc1.Cl | Does the drug listed below function as a hERG inhibitor? CCCOC(C(=O)OC1CCN(C)CC1)(c1ccccc1)c1ccccc1.Cl |
60203a71-c5f6-4c9c-aa9f-5542bd54e270 | Yes | Cc1cccc(C)c1NC(=O)CC12CCC[NH+]1CCC2 | Does the specified drug exhibit hERG blocking activity? Cc1cccc(C)c1NC(=O)CC12CCC[NH+]1CCC2 |
4655812d-18d1-45f0-955f-a165345005b2 | Yes | CCCCN1CCCC[C@@H]1C(=O)Nc1c(C)cccc1C | Does the specified drug exhibit hERG blocking activity? CCCCN1CCCC[C@@H]1C(=O)Nc1c(C)cccc1C |
568a011f-260b-4466-a453-67b3949214c3 | Yes | CC(C)Oc1cc([C@H](C2=CN[C@@H](C(O)(C(F)(F)F)C(F)(F)F)S2)c2cc[n+]([O-])cc2)ccc1OC(F)F | Verify if this drug has hERG blocking properties. CC(C)Oc1cc([C@H](C2=CN[C@@H](C(O)(C(F)(F)F)C(F)(F)F)S2)c2cc[n+]([O-])cc2)ccc1OC(F)F |
08bb529e-db04-4e70-be65-55219dbde013 | Yes | CC(C)(O)[C@H]1C=CC([C@H](c2cc[n+](O)cc2)c2ccc(OC(F)F)c(OC3CCC3)c2)=CN1 | Assess if the following substance is a hERG blocker. CC(C)(O)[C@H]1C=CC([C@H](c2cc[n+](O)cc2)c2ccc(OC(F)F)c(OC3CCC3)c2)=CN1 |
117d9813-6878-49f4-8110-36ddf056ab80 | Yes | C[NH+]1CC[NH+](CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 | Is the drug in question known to block hERG channels? C[NH+]1CC[NH+](CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 |
8fd1e11b-4a66-469c-bd88-6a607b2bc8f2 | Yes | CC(C)(O)[C@H]1C=CC([C@H](c2cc[n+]([O-])cc2)c2ccc(OC(F)F)c(OC(F)F)c2)=CN1 | Does this drug act as a hERG channel blocker? CC(C)(O)[C@H]1C=CC([C@H](c2cc[n+]([O-])cc2)c2ccc(OC(F)F)c(OC(F)F)c2)=CN1 |
857d6410-4897-41b4-a284-603c15dc5190 | Yes | c1ccc(C2(c3ccccc3)C[C@H]2C2=[NH+]CCN2)cc1 | Does the specified drug exhibit hERG blocking activity? c1ccc(C2(c3ccccc3)C[C@H]2C2=[NH+]CCN2)cc1 |
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