COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522879
Chemical Name: (2E)-N-[4-(acetylamino)phenyl]-3-{3-[(2-chlorobenzyl)oxy]phenyl}-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1cccc(c1)OCc1ccccc1Cl)/C(=O)Nc1ccc(cc1)NC(=O)C

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Molecular Weight: 445.9
Empirical Formula: C25H20ClN3O3

Physical State: Dry powder
Available Amount: 170 mg

Lipinsky:
logP: 4.075
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 3

     

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