General Information of the Compound
| Compound ID |
CP0424907
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2-(7-methoxyphthalazin-1-yl)ethyl]cyclopropanecarboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C15H17N3O2
|
||||||||||||||||||
| Molecular Weight |
271.32
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc2cnnc(CCNC(=O)C3CC3)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H17N3O2/c1-20-12-5-4-11-9-17-18-14(13(11)8-12)6-7-16-15(19)10-2-3-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,16,19)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JDWBNGMESBOMNB-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