COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK676564
Chemical Name: 4-{3-[(N-{4-[chloro(difluoro)methoxy]phenyl}-N'-methylcarbamimidoyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoicacid
Smiles: C/N=C(\SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O)/Nc1ccc(cc1)OC(Cl)(F)F

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Saltdata: AcOH
Molecular Weight: 483.88
Empirical Formula: C20H16ClF2N3O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.291
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 133
Number of rings: 3

     

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