COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188020
Chemical Name: 4-chloro-3-{5-[(E)-(4,6-dioxo-1-phenyl-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: OC(=O)c1ccc(c(c1)c1ccc(o1)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccccc1)Cl

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Molecular Weight: 452.87
Empirical Formula: C22H13ClN2O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.165
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 131
Number of rings: 4

     

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