COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185250
Chemical Name: (5-bromo-4-{(1E)-3-[(3-chloro-4-methylphenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-2-methoxyphenoxy)aceticacid
Smiles: N#C/C(=C\c1cc(OC)c(cc1Br)OCC(=O)O)/C(=O)Nc1ccc(c(c1)Cl)C

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Molecular Weight: 479.71
Empirical Formula: C20H16BrClN2O5

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 4.94
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 108
Number of rings: 2

     

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