General Information of the Compound
| Compound ID |
CP0575027
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(4-fluoropiperidin-1-yl)-2-phenylmethoxy-N-pyridazin-4-ylbenzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H23FN4O2
|
||||||||||||||||||
| Molecular Weight |
406.461
|
||||||||||||||||||
| Canonical SMILES |
FC1CCN(CC1)c1ccc(OCc2ccccc2)c(c1)C(=O)Nc1ccnnc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H23FN4O2/c24-18-9-12-28(13-10-18)20-6-7-22(30-16-17-4-2-1-3-5-17)21(14-20)23(29)27-19-8-11-25-26-15-19/h1-8,11,14-15,18H,9-10,12-13,16H2,(H,25,27,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
QYNDNRURDHERQS-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