Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L0JKO6
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| Ligand Name |
(3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-({[3-(1-benzyl-1H-1,2,3-triazol-4-yl)propyl]sulfanyl}methyl)pyrrolidin-3-ol
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| Synonyms |
CHEMBL4439603; (3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-({[3-(1-benzyl-1H-1,2,3-triazol-4-yl)propyl]sulfanyl}methyl)pyrrolidin-3-ol; OS5; BDBM50510218
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| Structure |
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Download2D MOL |
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| Formula |
C24H30N8OS
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| Canonical SMILES |
C1C(C(CN1CC2=CNC3=C2N=CN=C3N)O)CSCCCC4=CN(N=N4)CC5=CC=CC=C5
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| InChI |
1S/C24H30N8OS/c25-24-23-22(27-16-28-24)18(9-26-23)11-31-12-19(21(33)14-31)15-34-8-4-7-20-13-32(30-29-20)10-17-5-2-1-3-6-17/h1-3,5-6,9,13,16,19,21,26,33H,4,7-8,10-12,14-15H2,(H2,25,27,28)/t19-,21+/m1/s1
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| InChIKey |
BROXRHKDLDDNBO-CTNGQTDRSA-N
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| PubChem Compound ID | ||||
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