General Information of the Compound
| Compound ID |
CP0556293
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-[6-(3-ethoxyphenyl)-3-methyl-6-bicyclo[3.1.0]hexanyl]-4-pyridin-3-ylpiperazine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H31N3O
|
||||||||||||||||||
| Molecular Weight |
377.532
|
||||||||||||||||||
| Canonical SMILES |
CCOc1cccc(c1)C1(C2CC(C)CC12)N1CCN(CC1)c1cccnc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H31N3O/c1-3-28-21-8-4-6-19(16-21)24(22-14-18(2)15-23(22)24)27-12-10-26(11-13-27)20-7-5-9-25-17-20/h4-9,16-18,22-23H,3,10-15H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
CUKMJOAAPROTTA-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