COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK192473
Chemical Name: 3-(5-{(E)-[1-(3-carboxyphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)-4-chlorobenzoicacid
Smiles: S=C1NC(=O)/C(=C\c2ccc(o2)c2cc(ccc2Cl)C(=O)O)/C(=O)N1c1cccc(c1)C(=O)O

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Molecular Weight: 496.88
Empirical Formula: C23H13ClN2O7S

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 4.841
Rotatable bonds: 6
H-donors: 3
H-acceptors: 7
PSA: 169
Number of rings: 4

     

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