COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK464677
Chemical Name: 2-{[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]carbonyl}-N-(4-nitrophenyl)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1)[N+](=O)[O-])NNC(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2

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Molecular Weight: 487.5
Empirical Formula: C24H17N5O5S

Physical State: Dry powder
Available Amount: 15 mg

Lipinsky:
logP: 4.868
Rotatable bonds: 3
H-donors: 3
H-acceptors: 5
PSA: 162
Number of rings: 5

     

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