COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333861
Chemical Name: (4R,7S)-3-hydroxy-4-(3-nitrophenyl)-7-(thiophen-2-yl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: O=C1C[C@H](CC2=C1[C@H](c1cccc(c1)[N+](=O)[O-])c1c(N2)[nH]nc1O)c1cccs1

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Molecular Weight: 408.44
Empirical Formula: C20H16N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.164
Rotatable bonds: 1
H-donors: 3
H-acceptors: 4
PSA: 152
Number of rings: 5

     

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