General Information of the Compound
| Compound ID |
CP0424309
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(5-aminopentyl)-2-naphthalen-2-yloxy-N-spiro[5.5]undec-9-en-3-ylacetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H38N2O2
|
||||||||||||||||||
| Molecular Weight |
434.624
|
||||||||||||||||||
| Canonical SMILES |
NCCCCCN(C1CCC2(CCC=CC2)CC1)C(=O)COc1ccc2ccccc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H38N2O2/c29-19-7-2-8-20-30(25-13-17-28(18-14-25)15-5-1-6-16-28)27(31)22-32-26-12-11-23-9-3-4-10-24(23)21-26/h1,3-5,9-12,21,25H,2,6-8,13-20,22,29H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
INNLZENSZBQEAB-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: PT01325, Melanocortin receptor 3
Protein ID: PT00914, Melanocortin receptor 4
Protein ID: PT01804, Melanocortin receptor 5
Protein ID: PT01440, Melanocyte-stimulating hormone receptor