COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183632
Chemical Name: (2E)-N-(2-chlorophenyl)-2-cyano-3-{1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}prop-2-enamide
Smiles: N#C/C(=C\c1cccn1c1cccc(c1)C(F)(F)F)/C(=O)Nc1ccccc1Cl

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Molecular Weight: 415.8
Empirical Formula: C21H13ClF3N3O

Physical State: Dry powder
Available Amount: 376 mg

Lipinsky:
logP: 5.326
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 57
Number of rings: 3

     

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