General Information of the Compound
| Compound ID |
CP0877527
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-Isopropyl-N-[[1-[3-(methylamino)-3-oxo-1-propyl]-4-piperidinyl]methyl]-1H-indazole-3-carboxamide hydrochloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H32ClN5O2
|
||||||||||||||||||
| Molecular Weight |
421.973
|
||||||||||||||||||
| Canonical SMILES |
CNC(=O)CCN1CCC(CNC(=O)c2nn(C(C)C)c3ccccc23)CC1.Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H31N5O2.ClH/c1-15(2)26-18-7-5-4-6-17(18)20(24-26)21(28)23-14-16-8-11-25(12-9-16)13-10-19(27)22-3;/h4-7,15-16H,8-14H2,1-3H3,(H,22,27)(H,23,28);1H
Show/Hide
|
||||||||||||||||||
| InChIKey |
KVZPMBRUAZYLFQ-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