COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333836
Chemical Name: 4-(5-chloro-2-hydroxyphenyl)-3-hydroxy-7-(thiophen-2-yl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: Clc1ccc(c(c1)C1C2=C(CC(CC2=O)c2cccs2)Nc2c1c(O)n[nH]2)O

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Molecular Weight: 413.88
Empirical Formula: C20H16ClN3O3S

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 3.642
Rotatable bonds: 4
H-donors: 4
H-acceptors: 3
PSA: 126
Number of rings: 5

     

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