COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810338
Chemical Name: prop-2-en-1-yl2-({3-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCOC(=O)c1sc(nc1C)NC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)F)/C1=O

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Saltdata: 1/3CH3COOH
Molecular Weight: 491.59
Empirical Formula: C21H18FN3O4S3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.994
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 174
Number of rings: 3

     

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