COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045508
Chemical Name: 2-{(2E)-2-[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]ethyl}pentanedioicacid
Smiles: OC(=O)CCC(C(=O)O)C/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)F)S

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Molecular Weight: 394.38
Empirical Formula: C17H15FN2O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.762
Rotatable bonds: 9
H-donors: 2
H-acceptors: 6
PSA: 163
Number of rings: 2

     

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