General
Preferred name
SAXAGLIPTIN HYDRATE
Synonyms
Saxagliptin ()
Saxagliptin (hydrate) ()
BMS-477118 hydrate ()
Onglyza hydrate ()
SAXAGLIPTIN ()
BMS-477118 hydrate, Onglyza hydrate, BMS 477118 hydrate, BMS477118 hydrate ()
NSC-760407 ()
BMS-477118 ()
Saxagliptin monohydrate ()
BMS-477118-11 ()
Saxagliptin hydrate ()
Onglyza ()
P&D ID
PD071579
CAS
945667-22-1
Tags
natural product
drug
available
Drug Status
approved
Max Phase
Phase 4
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
5
ChEMBL Approved Drugs
ChEMBL Drugs
LSP-MoA library (Laboratory of Systems Pharmacology)
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
7
Properties
(calculated by RDKit )
Molecular Weight
333.21
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
2
Rotatable Bonds
2
Ring Count
6
Aromatic Ring Count
0
cLogP
0.33
TPSA
121.85
Fraction CSP3
0.89
Chiral centers
6.0
Largest ring
6.0
QED
0.76
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Dipeptidyl Peptidase
DPP-4
DPP
Pathway
Metabolic Enzyme/Protease
Proteases/Proteasome
Source data
