COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK533538
Chemical Name: 4-({4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

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Molecular Weight: 460.96
Empirical Formula: C21H17ClN2O4S2

Physical State: Dry powder
Available Amount: 354 mg

Lipinsky:
logP: 3.865
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 144
Number of rings: 3

     

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