COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL063300
Chemical Name: methyl2-({[(2E)-3-(4-methylphenyl)prop-2-enoyl]carbamothioyl}amino)benzoate
Smiles: COC(=O)c1ccccc1NC(=S)NC(=O)/C=C/c1ccc(cc1)C

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Molecular Weight: 354.43
Empirical Formula: C19H18N2O3S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 5.353
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 99
Number of rings: 2

     

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