COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112353
Chemical Name: (2E)-3-{4-[(2-chlorobenzyl)oxy]phenyl}-2-[(4-methylphenyl)carbonyl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(cc1)OCc1ccccc1Cl)/C(=O)c1ccc(cc1)C

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Molecular Weight: 387.87
Empirical Formula: C24H18ClNO2

Physical State: Dry powder
Available Amount: 282 mg

Lipinsky:
logP: 6.321
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 50
Number of rings: 3

     

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