General Information of the Compound
| Compound ID |
CP0526861
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[[6-tert-butyl-2-(4-methylpiperidin-1-yl)pyridin-3-yl]methyl]-2-(2,3-dihydro-1H-inden-5-yl)propanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H39N3O
|
||||||||||||||||||
| Molecular Weight |
433.64
|
||||||||||||||||||
| Canonical SMILES |
CC(C(=O)NCc1ccc(nc1N1CCC(C)CC1)C(C)(C)C)c1ccc2CCCc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H39N3O/c1-19-13-15-31(16-14-19)26-24(11-12-25(30-26)28(3,4)5)18-29-27(32)20(2)22-10-9-21-7-6-8-23(21)17-22/h9-12,17,19-20H,6-8,13-16,18H2,1-5H3,(H,29,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
NVLMIHWURQQJIL-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