General Information of the Compound
| Compound ID |
CP0534635
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[4-[[4-[3-(1,3-benzodioxol-5-yl)-1-cyclopropylpyrazol-4-yl]oxypyridin-2-yl]amino]pyridin-2-yl]propan-2-ol
Show/Hide
|
||||||||||||||||||
| Formula |
C26H25N5O4
|
||||||||||||||||||
| Molecular Weight |
471.517
|
||||||||||||||||||
| Canonical SMILES |
CC(C)(O)c1cc(Nc2cc(Oc3cn(nc3-c3ccc4OCOc4c3)C3CC3)ccn2)ccn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H25N5O4/c1-26(2,32)23-12-17(7-9-27-23)29-24-13-19(8-10-28-24)35-22-14-31(18-4-5-18)30-25(22)16-3-6-20-21(11-16)34-15-33-20/h3,6-14,18,32H,4-5,15H2,1-2H3,(H,27,28,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VGZJHPJPSRIDQI-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