General Information of the Compound
| Compound ID |
CP0396715
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[6-[(dimethylamino)methyl]-5,6,7,8-tetrahydronaphthalen-2-yl]-4-(4-ethylphenyl)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H32N2O
|
||||||||||||||||||
| Molecular Weight |
412.577
|
||||||||||||||||||
| Canonical SMILES |
CCc1ccc(cc1)-c1ccc(cc1)C(=O)Nc1ccc2CC(CN(C)C)CCc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H32N2O/c1-4-20-5-8-22(9-6-20)23-11-13-24(14-12-23)28(31)29-27-16-15-25-17-21(19-30(2)3)7-10-26(25)18-27/h5-6,8-9,11-16,18,21H,4,7,10,17,19H2,1-3H3,(H,29,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
IOHAOIFSDVOIOB-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: PT01027, Melanin-concentrating hormone receptor 1
Protein ID: PT01388, Melanin-concentrating hormone receptor 1