COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183612
Chemical Name: 4-[(2-chloro-4-{(1E)-2-cyano-3-[(4-methylphenyl)amino]-3-oxoprop-1-en-1-yl}-6-methoxyphenoxy)methyl]benzoicacid
Smiles: N#C/C(=C\c1cc(Cl)c(c(c1)OC)OCc1ccc(cc1)C(=O)O)/C(=O)Nc1ccc(cc1)C

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Molecular Weight: 476.92
Empirical Formula: C26H21ClN2O5

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 5.79
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 108
Number of rings: 3

     

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