CLIDINIUM

Search structure
Synonyms:
Status: Approved (1982)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: BO76JF850N

Structure
InChI Key HOOSGZJRQIVJSZ-UHFFFAOYSA-N
Smile C[N+]12CCC(CC1)C(OC(=O)C(O)(c1ccccc1)c1ccccc1)C2
InChI
InChI=1S/C22H26NO3/c1-23-14-12-17(13-15-23)20(16-23)26-21(24)22(25,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,17,20,25H,12-16H2,1H3/q+1

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H26NO3+
Molecular Weight 352.45
AlogP 2.7
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 46.53
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 26.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 95170
ChEMBL CHEMBL620
DrugCentral 676
EPA CompTox DTXSID6045379
FDA SRS BO76JF850N
Guide to Pharmacology 351
KEGG C07853
PharmGKB PA164781044
PubChem 2784
SureChEMBL SCHEMBL14095206
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