COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551964
Chemical Name: ethyl5-cyano-4-(2-fluorophenyl)-2-oxo-6-[(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1F)C#N)SCC(=O)Nc1cccc(c1)C(F)(F)F

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Molecular Weight: 521.49
Empirical Formula: C24H19F4N3O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 6.231
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 133
Number of rings: 3

     

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