General Information of the Compound
| Compound ID |
CP0481370
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-[3-[1-(3,4-dichlorophenyl)pyrazol-3-yl]oxypropyl]-4-methylpiperazine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H22Cl2N4O
|
||||||||||||||||||
| Molecular Weight |
369.296
|
||||||||||||||||||
| Canonical SMILES |
CN1CCN(CCCOc2ccn(n2)-c2ccc(Cl)c(Cl)c2)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H22Cl2N4O/c1-21-8-10-22(11-9-21)6-2-12-24-17-5-7-23(20-17)14-3-4-15(18)16(19)13-14/h3-5,7,13H,2,6,8-12H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
MJMOQWXPFHTRIE-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