COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK335370
Chemical Name: 2-[3-methyl-4-(3-nitrophenyl)-5-oxo-7-(thiophen-2-yl)-4,5,6,7,8,9-hexahydro-1H-pyrazolo[3,4-b]quinolin-1-yl]benzoicacid
Smiles: O=C1CC(CC2=C1C(c1cccc(c1)[N+](=O)[O-])c1c(N2)n(nc1C)c1ccccc1C(=O)O)c1cccs1

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Molecular Weight: 526.57
Empirical Formula: C28H22N4O5S

Physical State: Dry powder
Available Amount: 220 mg

Lipinsky:
logP: 5.201
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 158
Number of rings: 6

     

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