COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK172640
Chemical Name: 2-chloro-N-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]carbonothioyl}-4-methylbenzamide
Smiles: Cc1ccc(c(c1)Cl)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 453.35
Empirical Formula: C19H18Cl2N4O3S

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 4.124
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 113
Number of rings: 3

     

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