General Information of the Compound
| Compound ID |
CP0428316
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
AHR-504
Show/Hide
|
||||||||||||||||||
| Synonyms |
(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate
13283-82-4
AC1L1G28
AC1Q60WT
BPBio1_000806
BSPBio_000732
G00010-Watson-Int
GTPL7459
Glycopyrronium (USAN)
MCD-386/glycopyrrolate
NCGC00179456-02
Prestwick0_000746
Prestwick1_000746
Prestwick2_000746
Prestwick3_000746
Pyrrolidinium,
SCHEMBL133002
SPBio_002671
Tovanor Breezhaler
beta-1-Methyl-3-pyrrolidyl-alpha-cyclopentylmandelate methobromide
zlchem 10
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H28NO3+
|
||||||||||||||||||
| Molecular Weight |
318.437
|
||||||||||||||||||
| Canonical SMILES |
C[N+]1(C)CCC(C1)OC(=O)C(O)(C1CCCC1)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H28NO3/c1-20(2)13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15/h3-5,8-9,16-17,22H,6-7,10-14H2,1-2H3/q+1
Show/Hide
|
||||||||||||||||||
| InChIKey |
ANGKOCUUWGHLCE-UHFFFAOYSA-N
|
||||||||||||||||||
| CAS |
13283-82-4
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
| DrugBank ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01198, Muscarinic acetylcholine receptor M2
Protein ID: PT01266, Muscarinic acetylcholine receptor M3
Clinical Information about the Compound