General Information of the Compound
| Compound ID |
CP0562318
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(1,3-benzodioxol-5-ylmethyl)-6-fluoro-1H-indazol-3-amine
Show/Hide
|
||||||||||||||||||
| Formula |
C15H12FN3O2
|
||||||||||||||||||
| Molecular Weight |
285.278
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc2c(NCc3ccc4OCOc4c3)n[nH]c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H12FN3O2/c16-10-2-3-11-12(6-10)18-19-15(11)17-7-9-1-4-13-14(5-9)21-8-20-13/h1-6H,7-8H2,(H2,17,18,19)
Show/Hide
|
||||||||||||||||||
| InChIKey |
NTLJMHVHZUHDOI-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 | |||||||||||||||||||
| 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