COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK072118
Chemical Name: 2-chloro-N-[3-({[(2E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioyl}amino)phenyl]benzamide
Smiles: S=C(Nc1cccc(c1)NC(=O)c1ccccc1Cl)NC(=O)/C=C/c1ccc(cc1)Cl

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Molecular Weight: 470.38
Empirical Formula: C23H17Cl2N3O2S

Physical State: Dry powder
Available Amount: 242 mg

Lipinsky:
logP: 5.444
Rotatable bonds: 2
H-donors: 3
H-acceptors: 2
PSA: 102
Number of rings: 3

     

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