COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK000620
Chemical Name: N-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]carbonothioyl}-3,4-dimethylbenzamide
Smiles: S=C(N1CCN(CC1)c1ccc(cc1Cl)[N+](=O)[O-])NC(=O)c1ccc(c(c1)C)C

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Molecular Weight: 432.93
Empirical Formula: C20H21ClN4O3S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 4.411
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 113
Number of rings: 3

     

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