COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK039734
Chemical Name: 4-({4-chloro-2-[(1E)-2-cyano-3-oxo-3-(phenylamino)prop-1-en-1-yl]phenoxy}methyl)benzoicacid
Smiles: N#C/C(=C\c1cc(Cl)ccc1OCc1ccc(cc1)C(=O)O)/C(=O)Nc1ccccc1

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Molecular Weight: 432.86
Empirical Formula: C24H17ClN2O4

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 5.418
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 99
Number of rings: 3

     

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