COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK362082
Chemical Name: 2-[(1E)-3-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-2-cyano-3-oxoprop-1-en-1-yl]phenyl4-methylbenzenesulfonate
Smiles: N#C/C(=C\c1ccccc1OS(=O)(=O)c1ccc(cc1)C)/C(=O)Nc1cc(ccc1Cl)C(F)(F)F

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Molecular Weight: 520.92
Empirical Formula: C24H16ClF3N2O4S

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 6.619
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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