General Information of the Compound
| Compound ID |
CP0527138
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[[5-(3-methylphenyl)-1-octylindol-3-yl]methyl]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H34N2O
|
||||||||||||||||||
| Molecular Weight |
390.571
|
||||||||||||||||||
| Canonical SMILES |
CCCCCCCCn1cc(CNC(C)=O)c2cc(ccc12)-c1cccc(C)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H34N2O/c1-4-5-6-7-8-9-15-28-19-24(18-27-21(3)29)25-17-23(13-14-26(25)28)22-12-10-11-20(2)16-22/h10-14,16-17,19H,4-9,15,18H2,1-3H3,(H,27,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JMYKKPLWVIFPFM-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