COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183186
Chemical Name: 4-[(2-{(1E)-3-[(3-bromophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}phenoxy)methyl]benzoicacid
Smiles: N#C/C(=C\c1ccccc1OCc1ccc(cc1)C(=O)O)/C(=O)Nc1cccc(c1)Br

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Molecular Weight: 477.31
Empirical Formula: C24H17BrN2O4

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.928
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 99
Number of rings: 3

     

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