General Information of the Compound
| Compound ID |
CP0446858
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[3-(naphthalen-1-ylamino)-1H-indazol-5-yl]oxane-4-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H22N4O2
|
||||||||||||||||||
| Molecular Weight |
386.455
|
||||||||||||||||||
| Canonical SMILES |
O=C(Nc1ccc2[nH]nc(Nc3cccc4ccccc34)c2c1)C1CCOCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H22N4O2/c28-23(16-10-12-29-13-11-16)24-17-8-9-21-19(14-17)22(27-26-21)25-20-7-3-5-15-4-1-2-6-18(15)20/h1-9,14,16H,10-13H2,(H,24,28)(H2,25,26,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
WMMOWBCDCOMAGL-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