General Information of the Compound
| Compound ID |
CP0847713
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N,N-dimethyl-5-(4-phenoxybenzamido)pentylamine hydrochloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H27ClN2O2
|
||||||||||||||||||
| Molecular Weight |
362.901
|
||||||||||||||||||
| Canonical SMILES |
CN(C)CCCCCNC(=O)c1ccc(Oc2ccccc2)cc1.Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H26N2O2.ClH/c1-22(2)16-8-4-7-15-21-20(23)17-11-13-19(14-12-17)24-18-9-5-3-6-10-18;/h3,5-6,9-14H,4,7-8,15-16H2,1-2H3,(H,21,23);1H
Show/Hide
|
||||||||||||||||||
| InChIKey |
IHMVANALPHZKRS-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: PT03226, Trace amine-associated receptor 1
Protein ID: PT03501, Trace amine-associated receptor 1