COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK178784
Chemical Name: (2Z)-2-cyano-N-(3-methoxyphenyl)-3-{1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}prop-2-enamide
Smiles: COc1cccc(c1)NC(=O)/C(=C\c1cccn1c1cccc(c1)C(F)(F)F)/C#N

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Molecular Weight: 411.38
Empirical Formula: C22H16F3N3O2

Physical State: Dry powder
Available Amount: 384 mg

Lipinsky:
logP: 5.077
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 67
Number of rings: 3

     

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