COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188200
Chemical Name: 4-(5-{(E)-[1-(4-chlorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: Clc1ccc(cc1)N1C(=S)NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2)C(=O)O)/C1=O

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Molecular Weight: 452.87
Empirical Formula: C22H13ClN2O5S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 5.035
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 131
Number of rings: 4

     

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