Grundinformationen
- Standard-SMILES
CC(N)C12CC3CC(CC(C3)C1)C2.Cl- InChIKey
OZBDFBJXRJWNAV-UHFFFAOYSA-N- Summenformel
- C12H22ClN
- Durchschnittliche Molmasse
- 215,76 g/mol
- Monoisotopische Masse
- 215,14407738
Überblick
Rimantadine hydrochloride is an organic molecular entity.
Namen und Bezeichner
- Bevorzugter Name
- Rimantadine Hydrochloride
- IUPAC
- 1-(1-adamantyl)ethanamine;hydrochloride
Namen und Synonyme
Rimantadine hydrochloride1501-84-4FlumadineRimantadine HCLMeradanealpha-Methyl-1-adamantanemethylamine hydrochlorideEXP 1261-(1-Aminoethyl)adamantane hydrochlorideMeradanJP 61DTXSID1047813EXP-126
Weitere Namen anzeigen
JEI07OOS8YNSC-206764Adamantane, 1-(1-aminoethyl)-, hydrochlorideDTXCID3027790NSC206764RefChem:55983Hydrochloride, Rimantadine1-(1-ADAMANTYL)ETHYLAMINE HYDROCHLORIDE
Datenbank-Bezeichner
- CAS
1501-84-4- PubChem CID
- 15165
- DTXSID
DTXSID1047813- ChEMBL
CHEMBL1200355、CHEMBL535396- ChEBI
CHEBI:8865- UNII
- JEI07OOS8Y
- EC Number
- 604-725-9、934-821-9
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 26 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 14
- Formalladung
- 0
- Komplexität
- 180
Experimentelle und physikochemische Eigenschaften
Solubility
>32.4 [ug/mL] (The mean of the results at pH 7.4)
>32.4 [ug/mL] (The mean of the results at pH 7.4)
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Collision Cross Section146.2 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Gefahrenhinweise
Hazard Classes and Categories
Acute Tox. 4 (100%)
Acute Tox. 4 (100%)
Toxikologische Informationen
Drug Induced Liver Injury
Drug Induced Liver Injury Rank (DILIrank 2.0)
Rimantadine hydrochloride
vNo-DILI-concern
0
No match
DOI:10.1016/j.drudis.2016.02.015
Chemie und Industrie
Pharmakologische Informationen
FDA Pharmacological Classification
RIMANTADINE HYDROCHLORIDE
M2 Protein Inhibitors [MoA]; Influenza A M2 Protein Inhibitor [EPC]
MeSH Pharmacological Classification
Agents used in the prophylaxis or therapy of VIRUS DISEASES. Some of the ways they may act include preventing viral replication by inhibiting viral DNA polymerase; binding to specific cell-surface receptors and inhibiting viral penetration or uncoating; inhibiting viral protein synthesis; or blocking late stages of virus assembly.
Compounds that inhibit cell production of DNA or RNA.
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