COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333849
Chemical Name: {4-[(4S,7S)-3,5-dioxo-2-phenyl-7-(thiophen-2-yl)-2,3,4,5,6,7,8,9-octahydro-1H-pyrazolo[3,4-b]quinolin-4-yl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccc(cc1)[C@H]1C2=C(C[C@@H](CC2=O)c2cccs2)Nc2c1c(=O)n([nH]2)c1ccccc1

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Molecular Weight: 513.57
Empirical Formula: C28H23N3O5S

Physical State: Dry powder
Available Amount: 380 mg

Lipinsky:
logP: 2.737
Rotatable bonds: 3
H-donors: 3
H-acceptors: 5
PSA: 136
Number of rings: 6

     

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