COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL023856
Chemical Name: 4-chloro-2-{5-[(1,3-diethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: CCN1C(=S)N(CC)C(=O)C(=Cc2ccc(o2)c2cc(Cl)ccc2C(=O)O)C1=O

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Molecular Weight: 432.88
Empirical Formula: C20H17ClN2O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.486
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 123
Number of rings: 3

     

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