Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L8DUL3
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| Ligand Name |
(3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-({[3-(1-butyl-1H-1,2,3-triazol-4-yl)propyl]sulfanyl}methyl)pyrrolidin-3-ol
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| Synonyms |
CHEMBL4450105; (3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-({[3-(1-butyl-1H-1,2,3-triazol-4-yl)propyl]sulfanyl}methyl)pyrrolidin-3-ol; OS6; BDBM50510225
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| Structure |
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Download2D MOL |
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| Formula |
C21H32N8OS
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| Canonical SMILES |
CCCCN1C=C(N=N1)CCCSCC2CN(CC2O)CC3=CNC4=C3N=CN=C4N
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| InChI |
1S/C21H32N8OS/c1-2-3-6-29-11-17(26-27-29)5-4-7-31-13-16-10-28(12-18(16)30)9-15-8-23-20-19(15)24-14-25-21(20)22/h8,11,14,16,18,23,30H,2-7,9-10,12-13H2,1H3,(H2,22,24,25)/t16-,18+/m1/s1
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| InChIKey |
RDPUFRZNTDIFPO-AEFFLSMTSA-N
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| PubChem Compound ID | ||||
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