betanidine   Click here for help

GtoPdb Ligand ID: 7618

Synonyms: bethanidine | BW-467-C-60 | Tenathan®
Approved drug
betanidine is an approved drug
Compound class: Synthetic organic
Comment: Betanidine is a guanidinium-based sympatholytic antihypertensive drug.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 36.42
Molecular weight 177.13
XLogP 1.96
No. Lipinski's rules broken 0
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Canonical SMILES CNC(=NC)NCc1ccccc1
Isomeric SMILES CNC(=NC)NCc1ccccc1
InChI InChI=1S/C10H15N3/c1-11-10(12-2)13-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H2,11,12,13)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
1484 betanidine
Synonyms Click here for help
bethanidine | BW-467-C-60 | Tenathan®
Database Links Click here for help
CAS Registry No. 55-73-2
ChEMBL Ligand CHEMBL1201260
DrugBank Ligand DB00217
DrugCentral Ligand 359
GtoPdb PubChem SID 223365953
PubChem CID 2368
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UniChem Compound Search for chemical match using the InChIKey NIVZHWNOUVJHKV-UHFFFAOYSA-N
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Wikipedia Bethanidine