COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826326
Chemical Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-5-cyano-4-(furan-2-yl)-6-({2-[(4-methoxy-2-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Smiles: COc1ccc(c(c1)[N+](=O)[O-])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: 648.02
Empirical Formula: C28H21ClF3N5O6S

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 6.468
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 187
Number of rings: 4

     

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