General Information of the Compound
| Compound ID |
CP0579078
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[4-[4-(4-methoxy-1-methyl-6-oxopyridin-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]piperidin-1-yl]-N,N-dimethylacetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H29N5O3
|
||||||||||||||||||
| Molecular Weight |
423.517
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(=O)n(C)cc1-c1ccnc2[nH]c(cc12)C1CCN(CC(=O)N(C)C)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H29N5O3/c1-26(2)22(30)14-28-9-6-15(7-10-28)19-11-17-16(5-8-24-23(17)25-19)18-13-27(3)21(29)12-20(18)31-4/h5,8,11-13,15H,6-7,9-10,14H2,1-4H3,(H,24,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FPBQNFXHVWPICG-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 | |||||||||||||||||||
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