General Information of the Compound
| Compound ID |
CP0411226
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
7-neopentyl-5-(piperidin-1-yl)-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridin-1-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H30N6
|
||||||||||||||||||
| Molecular Weight |
342.491
|
||||||||||||||||||
| Canonical SMILES |
CC(C)(C)CN1CCc2c(C1)c(nc1[nH]nc(N)c21)N1CCCCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H30N6/c1-19(2,3)12-24-10-7-13-14(11-24)18(25-8-5-4-6-9-25)21-17-15(13)16(20)22-23-17/h4-12H2,1-3H3,(H3,20,21,22,23)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZYPFDZVGEMPHMZ-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
Protein ID: PT05288, Bombesin receptor subtype-3
Protein ID: PT01996, Bombesin receptor subtype-3