COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK435278
Chemical Name: (2E)-2-cyano-N-(2,4-dimethoxyphenyl)-3-[3-(4-methylphenyl)-1H-pyrazol-4-yl]prop-2-enamide
Smiles: N#C/C(=C\c1c[nH]nc1c1ccc(cc1)C)/C(=O)Nc1ccc(cc1OC)OC

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Molecular Weight: 388.43
Empirical Formula: C22H20N4O3

Physical State: Dry powder
Available Amount: 663 mg

Lipinsky:
logP: 3.578
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 100
Number of rings: 3

     

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