General Information of the Compound
| Compound ID |
CP0501068
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(1-(2-(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)ethyl)piperidin-4-yl)-3-(naphthalen-2-yl)urea
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H35N3O
|
||||||||||||||||||
| Molecular Weight |
417.597
|
||||||||||||||||||
| Canonical SMILES |
CC1(C)C2CC1C(CCN1CCC(CC1)NC(=O)Nc1ccc3ccccc3c1)=CC2
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H35N3O/c1-27(2)22-9-7-20(25(27)18-22)11-14-30-15-12-23(13-16-30)28-26(31)29-24-10-8-19-5-3-4-6-21(19)17-24/h3-8,10,17,22-23,25H,9,11-16,18H2,1-2H3,(H2,28,29,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZWEFOCKTWYGPJI-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