COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK469973
Chemical Name: (2E)-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-phenyl-1H-pyrazol-4-yl)prop-2-enamide
Smiles: N#C/C(=C\c1c[nH]nc1c1ccccc1)/C(=O)NCCc1ccc(c(c1)OC)OC

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Molecular Weight: 402.45
Empirical Formula: C23H22N4O3

Physical State: Dry powder
Available Amount: 251 mg

Lipinsky:
logP: 2.91
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 100
Number of rings: 3

     

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