Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L1NXB9
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| Ligand Name |
2-Chloro-4-[(3s,3as,4s)-4-Hydroxy-3-Methoxy-3a,4,5,6-Tetrahydro-3h-Pyrrolo[1,2-B]pyrazol-2-Yl]-3-Methylbenzonitrile
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| Synonyms |
CHEMBL3326454; 2-Chloro-4-[(3s,3as,4s)-4-Hydroxy-3-Methoxy-3a,4,5,6-Tetrahydro-3h-Pyrrolo[1,2-B]pyrazol-2-Yl]-3-Methylbenzonitrile; 2-chloro-4-((3S,3aS,4S)-4-hydroxy-3-methoxy-3a,4,5,6-tetrahydro-3H-pyrrolo[1,2-b]pyrazol-2-yl)-3-methylbenzonitrile; SCHEMBL14661286; BDBM50057651; Q27461662; 1421375-26-9; 4-[(3S)-4beta-Hydroxy-3beta-methoxy-3abeta,4,5,6-tetrahydro-3H-pyrrolo[1,2-b]pyrazole-2-yl]-2-chloro-3-methylbenzonitrile
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| Structure |
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Download2D MOL |
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| Formula |
C15H16ClN3O2
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| Canonical SMILES |
CC1=C(C=CC(=C1Cl)C#N)C2=NN3CCC(C3C2OC)O
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| InChI |
1S/C15H16ClN3O2/c1-8-10(4-3-9(7-17)12(8)16)13-15(21-2)14-11(20)5-6-19(14)18-13/h3-4,11,14-15,20H,5-6H2,1-2H3/t11-,14-,15+/m0/s1
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| InChIKey |
RJZJEPYCJHLWQR-TUKIKUTGSA-N
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| PubChem Compound ID | ||||
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