COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK115359
Chemical Name: 2-methyl-3-(5-{(E)-[2,4,6-trioxo-1-(prop-2-en-1-yl)tetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: C=CCN1C(=O)NC(=O)/C(=C\c2ccc(o2)c2cccc(c2C)C(=O)O)/C1=O

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Molecular Weight: 380.36
Empirical Formula: C20H16N2O6

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 3.497
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 116
Number of rings: 3

     

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