COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381438
Chemical Name: (2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-[1-(3,5-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]prop-2-enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1cc(Cl)cc(c1)Cl)C)/C(=O)Nc1cc(ccc1Cl)C(F)(F)F

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Molecular Weight: 512.75
Empirical Formula: C23H15Cl3F3N3O

Physical State: Dry powder
Available Amount: 343 mg

Lipinsky:
logP: 8.301
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 57
Number of rings: 3

     

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