General Information of the Compound
| Compound ID |
CP0389648
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
9-[3-(4-Fluoro-phenyl)-propyl]-4,5,6a,7,8,9,10,10a-octahydro-pyrido[4,3-b]pyrrolo[3,2,1-hi]indole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H25FN2
|
||||||||||||||||||
| Molecular Weight |
336.454
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc(CCCN2CCC3C(C2)c2cccc4CCN3c24)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H25FN2/c23-18-8-6-16(7-9-18)3-2-12-24-13-11-21-20(15-24)19-5-1-4-17-10-14-25(21)22(17)19/h1,4-9,20-21H,2-3,10-15H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
GCWSOKYFEWNCMI-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