COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333911
Chemical Name: (4R,7S)-3-hydroxy-4-(3-hydroxy-4-methoxyphenyl)-7-(thiophen-2-yl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: COc1ccc(cc1O)[C@H]1C2=C(C[C@@H](CC2=O)c2cccs2)Nc2c1c(O)n[nH]2

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Molecular Weight: 409.47
Empirical Formula: C21H19N3O4S

Physical State: Dry powder
Available Amount: 454 mg

Lipinsky:
logP: 2.403
Rotatable bonds: 3
H-donors: 4
H-acceptors: 4
PSA: 135
Number of rings: 5

     

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