COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826449
Chemical Name: ethyl4-[({[5-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-3-cyano-4-(furan-2-yl)-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1cc(ccc1Cl)C(F)(F)F)c1ccco1

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Molecular Weight: 645.06
Empirical Formula: C30H24ClF3N4O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.473
Rotatable bonds: 7
H-donors: 3
H-acceptors: 5
PSA: 158
Number of rings: 4

     

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