General Information of the Compound
| Compound ID |
CP0550413
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[5-[3-chloro-4-(1-pyridin-2-ylethylamino)quinolin-6-yl]pyrimidin-2-yl]propan-2-ol
Show/Hide
|
||||||||||||||||||
| Formula |
C23H22ClN5O
|
||||||||||||||||||
| Molecular Weight |
419.916
|
||||||||||||||||||
| Canonical SMILES |
CC(Nc1c(Cl)cnc2ccc(cc12)-c1cnc(nc1)C(C)(C)O)c1ccccn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H22ClN5O/c1-14(19-6-4-5-9-25-19)29-21-17-10-15(7-8-20(17)26-13-18(21)24)16-11-27-22(28-12-16)23(2,3)30/h4-14,30H,1-3H3,(H,26,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SLKZPRFZJOVYEX-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