UCSF

ZINC03995890

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2005 11 Yes

Popular Name: MFCD00133247 MFCD00133247

Find On: PubMed — Wikipedia — Google

CAS Numbers: 73465-43-7 , 84444-90-6 , [73465-43-7]

Download: MOL2 SDF SMILES Flexibase

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) -2.40 -8.83 -37.78 6 5 1 98 164.181 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 197.5-198.7° Matrix Scientific
Purity 97+% Matrix Scientific
Warnings Irritant Matrix Scientific

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
FUCO-3-E Alpha-L-fucosidase 1 (cluster #3 Of 3), Eukaryotic Eukaryotes 4700 0.68 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
FUCO_BOVIN Q2KIM0 Alpha-L-fucosidase 1, Bovin 4700 0.68 Binding ≤ 10μM
FUCO_HUMAN P04066 Alpha-L-fucosidase I, Human 4700 0.68 Binding ≤ 10μM

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