General Information of the Compound
| Compound ID |
CP0565757
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-[3-(2-methoxyphenyl)-5-methyl-3,4-dihydropyrazol-2-yl]-2-(4-methoxypiperidin-1-yl)ethanone
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H27N3O3
|
||||||||||||||||||
| Molecular Weight |
345.443
|
||||||||||||||||||
| Canonical SMILES |
COC1CCN(CC(=O)N2N=C(C)CC2c2ccccc2OC)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H27N3O3/c1-14-12-17(16-6-4-5-7-18(16)25-3)22(20-14)19(23)13-21-10-8-15(24-2)9-11-21/h4-7,15,17H,8-13H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
QUYGKIBRMKMIJJ-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