COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473633
Chemical Name: (2E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(1,3-diphenyl-1H-pyrazol-4-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1ccccc1)c1ccccc1)/C(=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 448.48
Empirical Formula: C27H20N4O3

Physical State: Dry powder
Available Amount: 351 mg

Lipinsky:
logP: 5.014
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 5

     

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