COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK334117
Chemical Name: (4R,7S)-7-(3,4-dimethoxyphenyl)-3-hydroxy-4-(3-nitrophenyl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: COc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1c([C@H]2c2cccc(c2)[N+](=O)[O-])c(n[nH]1)O

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Molecular Weight: 462.46
Empirical Formula: C24H22N4O6

Physical State: Dry powder
Available Amount: 398 mg

Lipinsky:
logP: 3.223
Rotatable bonds: 3
H-donors: 3
H-acceptors: 6
PSA: 142
Number of rings: 5

     

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