COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK187369
Chemical Name: 3-({2-chloro-4-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}methyl)benzoicacid
Smiles: S=C1N(C)C(=O)C(=Cc2ccc(c(c2)Cl)OCc2cccc(c2)C(=O)O)C(=O)N1C

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Molecular Weight: 444.9
Empirical Formula: C21H17ClN2O5S

Available Amount: 0 mg

Lipinsky:
logP: 3.099
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 119
Number of rings: 3

     

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