COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK129634
Chemical Name: 3-chloro-N-[3-({[(2E)-3-(3-nitrophenyl)prop-2-enoyl]carbamothioyl}amino)phenyl]benzamide
Smiles: S=C(Nc1cccc(c1)NC(=O)c1cccc(c1)Cl)NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 480.93
Empirical Formula: C23H17ClN4O4S

Physical State: Dry powder
Available Amount: 369 mg

Lipinsky:
logP: 5.741
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 148
Number of rings: 3

     

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