COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK422851
Chemical Name: (2E)-2-cyano-3-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]-N-[1-(3,4-dimethylphenyl)ethyl]prop-2-enamide
Smiles: N#C/C(=C\c1c[nH]nc1c1ccc(c(c1)OC)OC)/C(=O)NC(c1ccc(c(c1)C)C)C

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Molecular Weight: 430.51
Empirical Formula: C25H26N4O3

Physical State: Dry powder
Available Amount: 671 mg

Lipinsky:
logP: 3.859
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 100
Number of rings: 3

     

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