Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LF28KI
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| Ligand Name |
Nvs-bet-1
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| Synonyms |
NVS-BET-1; (4~{R})-4-(4-chlorophenyl)-1-cyclopropyl-5-(1,5-dimethyl-6-oxidanylidene-pyridin-3-yl)-3-methyl-4~{H}-pyrrolo[3,4-c]pyrazol-6-one; CHEMBL3650899; SCHEMBL16244431; BDBM149993; rel-5-[(4R)-4-(4-chlorophenyl)-1-cyclopropyl-3-methyl-6-oxo-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-5-yl]-1,3-dimethyl-1,2-dihydropyridin-2-one; HY-142265; CS-0371552; US8975417, 49; EN300-37137744; 1639115-52-8; QFN
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| Structure |
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Download2D MOL |
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| Formula |
C22H21ClN4O2
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| Canonical SMILES |
CC1=CC(=CN(C1=O)C)N2C(C3=C(C2=O)N(N=C3C)C4CC4)C5=CC=C(C=C5)Cl
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| InChI |
1S/C22H21ClN4O2/c1-12-10-17(11-25(3)21(12)28)26-19(14-4-6-15(23)7-5-14)18-13(2)24-27(16-8-9-16)20(18)22(26)29/h4-7,10-11,16,19H,8-9H2,1-3H3/t19-/m1/s1
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| InChIKey |
PXGREUPWZAUELV-LJQANCHMSA-N
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| PubChem Compound ID | ||||
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