General Information of the Compound
| Compound ID |
CP0157080
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-cyclopentyloxy-7-methoxy-N-(4-methylphenyl)-1-phenyl-3,4-dihydroisoquinoline-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H30N2O3
|
||||||||||||||||||
| Molecular Weight |
454.57
|
||||||||||||||||||
| Canonical SMILES |
COc1cc2C(=NC(Cc2cc1OC1CCCC1)C(=O)Nc1ccc(C)cc1)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H30N2O3/c1-19-12-14-22(15-13-19)30-29(32)25-16-21-17-27(34-23-10-6-7-11-23)26(33-2)18-24(21)28(31-25)20-8-4-3-5-9-20/h3-5,8-9,12-15,17-18,23,25H,6-7,10-11,16H2,1-2H3,(H,30,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VMISFRHYDNYLNR-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