COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK422496
Chemical Name: (2E)-2-cyano-N-[1-(4-methylphenyl)ethyl]-3-(3-phenyl-1H-pyrazol-4-yl)prop-2-enamide
Smiles: N#C/C(=C\c1c[nH]nc1c1ccccc1)/C(=O)NC(c1ccc(cc1)C)C

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Molecular Weight: 356.43
Empirical Formula: C22H20N4O

Physical State: Dry powder
Available Amount: 1460 mg

Lipinsky:
logP: 3.911
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 81
Number of rings: 3

     

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