General Information of the Compound
| Compound ID |
CP0386337
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(1H-imidazol-2-yl)-N-methyl-2,3-dihydro-1H-indene-4-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H15N3O
|
||||||||||||||||||
| Molecular Weight |
241.294
|
||||||||||||||||||
| Canonical SMILES |
CNC(=O)c1cccc2C(CCc12)c1ncc[nH]1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H15N3O/c1-15-14(18)12-4-2-3-9-10(12)5-6-11(9)13-16-7-8-17-13/h2-4,7-8,11H,5-6H2,1H3,(H,15,18)(H,16,17)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SIMGMPZLDHYMNW-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: PT01089, Alpha-1A adrenergic receptor
Protein ID: PT01007, Alpha-1B adrenergic receptor
Protein ID: PT01004, Alpha-1D adrenergic receptor
Protein ID: PT01650, Alpha-2A adrenergic receptor