General Information of the Compound
| Compound ID |
CP0048096
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(3-benzylpyrrolidin-3-yl)-1-methyl-1H-indole
Show/Hide
|
||||||||||||||||||
| Synonyms |
5-(3-benzylpyrrolidin-3-yl)-1-methyl-1H-indole
CHEMBL459176
SCHEMBL981431
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H22N2
|
||||||||||||||||||
| Molecular Weight |
290.41
|
||||||||||||||||||
| Canonical SMILES |
Cn1ccc2cc(ccc12)C1(Cc2ccccc2)CCNC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H22N2/c1-22-12-9-17-13-18(7-8-19(17)22)20(10-11-21-15-20)14-16-5-3-2-4-6-16/h2-9,12-13,21H,10-11,14-15H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
OSXVIZKTSFAUPG-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
Clinical Information about the Compound