UCSF

ZINC01558399

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 21 No

Other Names:

MFCD00226754

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) 4.64 9.04 -3.22 0 3 0 39 361.011 1

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
GANAB-2-E Neutral Alpha-glucosidase AB (cluster #2 Of 2), Eukaryotic Eukaryotes 2600 0.37 Binding ≤ 10μM
GANC-2-E Neutral Alpha-glucosidase C (cluster #2 Of 2), Eukaryotic Eukaryotes 2600 0.37 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
GANAB_HUMAN Q14697 Neutral Alpha-glucosidase AB, Human 2600 0.37 Binding ≤ 10μM
GANC_HUMAN Q8TET4 Neutral Alpha-glucosidase C, Human 2600 0.37 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Calnexin/calreticulin cycle
N-glycan trimming in the ER and Calnexin/Calreticulin cycle

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

No pre-computed analogs available. Try a structural similarity search.