COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK207965
Chemical Name: 3-[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-6-nitro-4-phenylquinolin-2(1H)-one
Smiles: CCn1c(nnc1c1ccccc1)Sc1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)[N+](=O)[O-]

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Molecular Weight: 469.52
Empirical Formula: C25H19N5O3S

Physical State: Dry powder
Available Amount: 635 mg

Lipinsky:
logP: 7.291
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 130
Number of rings: 5

     

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