General Information of the Compound
| Compound ID |
CP0428895
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(R)-N-(naphthalen-2-ylmethyl)-N-(pyrrolidin-3-yl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H20N2O
|
||||||||||||||||||
| Molecular Weight |
268.36
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)N(Cc1ccc2ccccc2c1)[C@@H]1CCNC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H20N2O/c1-13(20)19(17-8-9-18-11-17)12-14-6-7-15-4-2-3-5-16(15)10-14/h2-7,10,17-18H,8-9,11-12H2,1H3/t17-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
DWBBFNBXAKCWFH-QGZVFWFLSA-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: PT00897, Potassium voltage-gated channel subfamily H member 2
Protein ID: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter