COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK706840
Chemical Name: (2Z)-2-(1H-benzimidazol-2-yl)-3-(3-{3-[(2-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile
Smiles: N#C/C(=C/c1cn(nc1c1cccc(c1)OCc1ccccc1Cl)c1ccccc1)/c1nc2c([nH]1)cccc2

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Molecular Weight: 528.01
Empirical Formula: C32H22ClN5O

Physical State: Dry powder
Available Amount: 407 mg

Lipinsky:
logP: 8.029
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 79
Number of rings: 6

     

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