General Information of the Compound
| Compound ID |
CP0404254
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2-(dimethylamino)ethyl]-3-(pyridin-2-ylmethyl)-1H-indene-2-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H23N3O
|
||||||||||||||||||
| Molecular Weight |
321.424
|
||||||||||||||||||
| Canonical SMILES |
CN(C)CCNC(=O)C1=C(Cc2ccccn2)c2ccccc2C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H23N3O/c1-23(2)12-11-22-20(24)19-13-15-7-3-4-9-17(15)18(19)14-16-8-5-6-10-21-16/h3-10H,11-14H2,1-2H3,(H,22,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
BOBFJOWTOWSGDG-UHFFFAOYSA-N
|
||||||||||||||||||
| 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 | |||||||||||||||||||
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: PT01310, Muscarinic acetylcholine receptor M1
Protein ID: PT01198, Muscarinic acetylcholine receptor M2
Protein ID: PT01266, Muscarinic acetylcholine receptor M3
Protein ID: PT01156, Muscarinic acetylcholine receptor M4
Protein ID: PT01516, Muscarinic acetylcholine receptor M5