COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434632
Chemical Name: (2E)-2-cyano-N-(2,5-dimethoxyphenyl)-3-[3-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enamide
Smiles: N#C/C(=C\c1c[nH]nc1c1ccc(cc1)CC)/C(=O)Nc1cc(OC)ccc1OC

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Molecular Weight: 402.45
Empirical Formula: C23H22N4O3

Physical State: Dry powder
Available Amount: 495 mg

Lipinsky:
logP: 4.589
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 100
Number of rings: 3

     

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