COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374493
Chemical Name: ethyl4-{[(2E,5Z)-5-(3-chloro-4-hydroxy-5-methoxybenzylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)/N=C\1/S/C(=C\c2cc(Cl)c(c(c2)OC)O)/C(=O)N1C

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Molecular Weight: 446.91
Empirical Formula: C21H19ClN2O5S

Physical State: Dry powder
Available Amount: 674 mg

Lipinsky:
logP: 5.35
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 113
Number of rings: 3

     

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