General Information of the Compound
| Compound ID |
CP0442381
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-chloro-N-(1-(naphthalen-2-ylmethyl)piperidin-4-yl)-1-(pyridin-2-ylmethyl)-1H-indazol-3-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H28ClN5
|
||||||||||||||||||
| Molecular Weight |
482.031
|
||||||||||||||||||
| Canonical SMILES |
Clc1ccc2n(Cc3ccccn3)nc(NC3CCN(Cc4ccc5ccccc5c4)CC3)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H28ClN5/c30-24-10-11-28-27(18-24)29(33-35(28)20-26-7-3-4-14-31-26)32-25-12-15-34(16-13-25)19-21-8-9-22-5-1-2-6-23(22)17-21/h1-11,14,17-18,25H,12-13,15-16,19-20H2,(H,32,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SJRILSZPAVZTBJ-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