General Information of the Compound
| Compound ID |
CP0125601
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-amino-N-[1-(5-chloro-2-methoxypyridin-4-yl)azetidin-3-yl]-2,3-dimethylindazole-5-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H21ClN6O2
|
||||||||||||||||||
| Molecular Weight |
400.87
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(N2CC(C2)NC(=O)c2ccc3nn(C)c(C)c3c2N)c(Cl)cn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H21ClN6O2/c1-10-17-14(24-25(10)2)5-4-12(18(17)21)19(27)23-11-8-26(9-11)15-6-16(28-3)22-7-13(15)20/h4-7,11H,8-9,21H2,1-3H3,(H,23,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OIQKUMPIYFHKIE-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