COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374864
Chemical Name: 2-chloro-5-{5-[(E)-(1-methyl-4,6-dioxo-3-phenyl-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: S=C1N(C)C(=O)/C(=C\c2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)/C(=O)N1c1ccccc1

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Molecular Weight: 466.9
Empirical Formula: C23H15ClN2O5S

Physical State: Dry powder
Available Amount: 1050 mg

Lipinsky:
logP: 4.409
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 123
Number of rings: 4

     

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