UCSF

ZINC18164733

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -1.64 -6.46 -8.59 4 5 0 98 164.157 4
Hi High (pH 8-9.5) -2.49 -5.34 -54.76 3 5 -1 101 163.149 4
Hi High (pH 8-9.5) -2.49 -5.37 -54.67 3 5 -1 101 163.149 4
Hi High (pH 8-9.5) -2.49 -3.81 -54.55 3 5 -1 101 163.149 4

Vendor Notes

Note Type Comments Provided By
MP 136-140°C Indofine
Melting_Point 139-142? Alfa-Aesar
Melting_Point 139-142° Alfa-Aesar
MP 140o C Indofine
Purity 95% Fluorochem
Patent Database Links EP1516881; EP1887017; US2007224139; US2007248556; US2007265210; WO2007116012 ChEBI
UniProt Database Links FUCA_ECO57; FUCA_ECOL6; FUCA_ECOLI; FUCA_HAEIN; FUCA_META3; FUCA_METJA; FUCA_METM5; FUCA_METM7; FUCA_METMP; FUCA_METVS; FUCA_SHIFL; FUCI_BACFN; FUCI_BACFR; FUCI_BACTN; FUCI_BACV8; FUCI_CITK8; FUCI_CLOPE; FUCI_ECO24; FUCI_ECO27; FUCI_ECO45; FUCI_ECO55; FUC ChEBI

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )