General Information of the Compound
| Compound ID |
CP0058927
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-[6-(1,4-diazepan-1-yl)pyrazin-2-yl]-1H-indazole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H18N6
|
||||||||||||||||||
| Molecular Weight |
294.362
|
||||||||||||||||||
| Canonical SMILES |
C1CNCCN(C1)c1cncc(n1)-c1ccc2[nH]ncc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H18N6/c1-4-17-5-7-22(6-1)16-11-18-10-15(20-16)12-2-3-14-13(8-12)9-19-21-14/h2-3,8-11,17H,1,4-7H2,(H,19,21)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JCDRCWSMYQGAAF-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