General Information of the Compound
| Compound ID |
CP0317553
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(cyclopentylmethyl)-5-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1,3,4-oxadiazol-2-one
Show/Hide
|
||||||||||||||||||
| Formula |
C19H23N3O3
|
||||||||||||||||||
| Molecular Weight |
341.411
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc2[nH]cc(CCc3nn(CC4CCCC4)c(=O)o3)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H23N3O3/c1-24-15-7-8-17-16(10-15)14(11-20-17)6-9-18-21-22(19(23)25-18)12-13-4-2-3-5-13/h7-8,10-11,13,20H,2-6,9,12H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
WYHAXZNIVSDTLE-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 | |||||||||||||||||||
| 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
Protein ID: PT01843, Melatonin receptor type 1A
Protein ID: PT02174, Melatonin receptor type 1B