COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172435
Chemical Name: 4-{[(2E,5Z)-5-(3-chloro-4,5-dimethoxybenzylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino}phenylpropanoate
Smiles: CCC(=O)Oc1ccc(cc1)/N=C\1/S/C(=C\c2cc(Cl)c(c(c2)OC)OC)/C(=O)N1

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Molecular Weight: 446.91
Empirical Formula: C21H19ClN2O5S

Physical State: Dry powder
Available Amount: 22 mg

Lipinsky:
logP: 2.787
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 111
Number of rings: 3

     

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