COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016218
Chemical Name: 4-[(2-bromo-4-{(1Z)-2-cyano-3-[(4-ethylphenyl)amino]-3-oxoprop-1-en-1-yl}phenoxy)methyl]benzoicacid
Smiles: CCc1ccc(cc1)NC(=O)/C(=C\c1ccc(c(c1)Br)OCc1ccc(cc1)C(=O)O)/C#N

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Molecular Weight: 505.37
Empirical Formula: C26H21BrN2O4

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 6.286
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 99
Number of rings: 3

     

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