COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431847
Chemical Name: butyl2-chloro-5-{5-[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}benzoate
Smiles: CCCCOC(=O)c1cc(ccc1Cl)c1ccc(o1)C=C1C(=O)NC(=S)NC1=O

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Molecular Weight: 432.88
Empirical Formula: C20H17ClN2O5S

Physical State: Dry powder
Available Amount: 146 mg

Lipinsky:
logP: 4.983
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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