General Information of the Compound
| Compound ID |
CP0335042
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
[3-[(4-chlorophenyl)-[2-(dimethylamino)pyridin-3-yl]methoxy]azetidin-1-yl]-piperidin-1-ylmethanone
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H29ClN4O2
|
||||||||||||||||||
| Molecular Weight |
428.964
|
||||||||||||||||||
| Canonical SMILES |
CN(C)c1ncccc1C(OC1CN(C1)C(=O)N1CCCCC1)c1ccc(Cl)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H29ClN4O2/c1-26(2)22-20(7-6-12-25-22)21(17-8-10-18(24)11-9-17)30-19-15-28(16-19)23(29)27-13-4-3-5-14-27/h6-12,19,21H,3-5,13-16H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZDGLZBVBKYHHGT-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