COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551197
Chemical Name: (2E)-2-cyano-N-(2,3-dimethylphenyl)-2-[4-oxo-3-phenyl-5-(prop-2-en-1-yl)-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: C=CCC1S/C(=C(/C(=O)Nc2cccc(c2C)C)\C#N)/N(C1=O)c1ccccc1

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Molecular Weight: 403.5
Empirical Formula: C23H21N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.117
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 98
Number of rings: 3

     

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