COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK187394
Chemical Name: 4-[(4-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)methyl]benzoicacid
Smiles: C=CCN1C(=S)NC(=O)/C(=C\c2ccc(cc2)OCc2ccc(cc2)C(=O)O)/C1=O

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Molecular Weight: 422.46
Empirical Formula: C22H18N2O5S

Physical State: Dry powder
Available Amount: 149 mg

Lipinsky:
logP: 3.647
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 128
Number of rings: 3

     

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