General Information of the Compound
| Compound ID |
CP0846757
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
[5-(1H-imidazol-4-yl)-pentyl]-isobutyl-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C12H23N3
|
||||||||||||||||||
| Molecular Weight |
209.337
|
||||||||||||||||||
| Canonical SMILES |
CC(C)CNCCCCCc1c[nH]cn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C12H23N3/c1-11(2)8-13-7-5-3-4-6-12-9-14-10-15-12/h9-11,13H,3-8H2,1-2H3,(H,14,15)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VOXJNIGKOFAGBU-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: PT01194, Histamine H3 receptor
Protein ID: PT01711, Histamine H4 receptor