General Information of the Compound
| Compound ID |
CP0851994
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-isopropyl-2-oxo-N-((1R,3r,5S)-8-(3-(piperidin-1-yl)propyl)-8-azabicyclo[3.2.1]octan-3-yl)-1,2-dihydroquinoline-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C28H40N4O2
|
||||||||||||||||||
| Molecular Weight |
464.654
|
||||||||||||||||||
| Canonical SMILES |
CC(C)n1c(=O)c(C(=O)N[C@H]2C[C@H]3CC[C@@H](C2)N3CCCN2CCCCC2)cc2ccccc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H40N4O2/c1-20(2)32-26-10-5-4-9-21(26)17-25(28(32)34)27(33)29-22-18-23-11-12-24(19-22)31(23)16-8-15-30-13-6-3-7-14-30/h4-5,9-10,17,20,22-24H,3,6-8,11-16,18-19H2,1-2H3,(H,29,33)/t22-,23+,24-
Show/Hide
|
||||||||||||||||||
| InChIKey |
FWPLUVHDRWZXEC-BKFWDETESA-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