General Information of the Compound
| Compound ID |
CP0553097
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(6-fluoro-2,3-dihydroindol-1-yl)-1-pyrrolidin-1-ylethanone
Show/Hide
|
||||||||||||||||||
| Formula |
C14H17FN2O
|
||||||||||||||||||
| Molecular Weight |
248.301
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc2CCN(CC(=O)N3CCCC3)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H17FN2O/c15-12-4-3-11-5-8-17(13(11)9-12)10-14(18)16-6-1-2-7-16/h3-4,9H,1-2,5-8,10H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
VTMJUDFKGWCUES-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 | |||||||||||||||||||
| 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