COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333920
Chemical Name: (4R,7S)-4-[4-(benzyloxy)-3-methoxyphenyl]-3-hydroxy-7-(thiophen-2-yl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: COc1cc(ccc1OCc1ccccc1)[C@H]1C2=C(C[C@@H](CC2=O)c2cccs2)Nc2c1c(O)n[nH]2

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Molecular Weight: 499.59
Empirical Formula: C28H25N3O4S

Physical State: Dry powder
Available Amount: 590 mg

Lipinsky:
logP: 4.827
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 124
Number of rings: 6

     

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