risedronate

Ligand id: 3176

Name: risedronate

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 5
Rotatable bonds 4
Topological polar surface area 167.8
Molecular weight 283
XLogP -3
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1998))
IUPAC Name
[1-hydroxy-1-phosphono-2-(pyridin-3-yl)ethyl]phosphonic acid
International Nonproprietary Names
INN number INN
6522 risedronic acid
Synonyms
Actonel® | Atelvia® | NE-58095 | risedronate sodium
Database Links
CAS Registry No. 105462-24-6 (source: Scifinder)
ChEMBL Ligand CHEMBL923
DrugBank Ligand DB00884
PubChem CID 5245
RCSB PDB Ligand RIS
Search Google for chemical match using the InChIKey IIDJRNMFWXDHID-UHFFFAOYSA-N
Search Google for chemicals with the same backbone IIDJRNMFWXDHID
Search PubMed clinical trials risedronic acid
Search PubMed titles risedronic acid
Search PubMed titles/abstracts risedronic acid
Search UniChem for chemical match using the InChIKey IIDJRNMFWXDHID-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone IIDJRNMFWXDHID
SynPHARM 7092 (in complex with farnesyl diphosphate synthase)
Wikipedia Risedronic acid
Comments
Risedronate is a bisphosphonate drug.