General Information of the Compound
| Compound ID |
CP0392756
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[4-(7-hydroxy-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]naphthalene-2-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H28N2O3
|
||||||||||||||||||
| Molecular Weight |
404.51
|
||||||||||||||||||
| Canonical SMILES |
COc1cc2CCN(CCCCNC(=O)c3ccc4ccccc4c3)Cc2cc1O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H28N2O3/c1-30-24-16-20-10-13-27(17-22(20)15-23(24)28)12-5-4-11-26-25(29)21-9-8-18-6-2-3-7-19(18)14-21/h2-3,6-9,14-16,28H,4-5,10-13,17H2,1H3,(H,26,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
BVFIHIUYFGGHND-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