COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK335284
Chemical Name: (4S,7S)-7-(3,4-dimethoxyphenyl)-4-(3-methylthiophen-2-yl)-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Smiles: COc1cc(ccc1OC)[C@H]1CC2=C(C(=O)C1)[C@@H](c1c(N2)[nH]n(c1=O)c1ccccc1)c1sccc1C

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Molecular Weight: 513.62
Empirical Formula: C29H27N3O4S

Physical State: Dry powder
Available Amount: 445 mg

Lipinsky:
logP: 3.812
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 108
Number of rings: 6

     

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