COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333447
Chemical Name: 3-hydroxy-4-(4-hydroxy-3-methoxy-5-nitrophenyl)-7,7-dimethyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: COc1cc(cc(c1O)[N+](=O)[O-])C1C2=C(Nc3c1c(O)n[nH]3)CC(CC2=O)(C)C

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Molecular Weight: 400.39
Empirical Formula: C19H20N4O6

Physical State: Dry powder
Available Amount: 724 mg

Lipinsky:
logP: 2.624
Rotatable bonds: 4
H-donors: 4
H-acceptors: 6
PSA: 153
Number of rings: 4

     

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