General Information of the Compound
| Compound ID |
CP0439207
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(4-methoxyphenyl)-1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H23N5O2
|
||||||||||||||||||
| Molecular Weight |
365.437
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(NC(=O)C2CCN(CC2)c2ncnc3[nH]cc(C)c23)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H23N5O2/c1-13-11-21-18-17(13)19(23-12-22-18)25-9-7-14(8-10-25)20(26)24-15-3-5-16(27-2)6-4-15/h3-6,11-12,14H,7-10H2,1-2H3,(H,24,26)(H,21,22,23)
Show/Hide
|
||||||||||||||||||
| InChIKey |
YUZYPXOGQFDMIJ-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