COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428764
Chemical Name: 2-[(4-methylphenyl)amino]-2-oxoethyl4-[(E)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzoate
Smiles: O=C(Nc1ccc(cc1)C)COC(=O)c1ccc(cc1)/C=C\1/SC(=S)N(C1=O)C

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Molecular Weight: 426.52
Empirical Formula: C21H18N2O4S2

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 3.312
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 133
Number of rings: 3

     

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