General Information of the Compound
| Compound ID |
CP0283022
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
AZD0530 analogue 27
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H27ClN4O4
|
||||||||||||||||||
| Molecular Weight |
470.957
|
||||||||||||||||||
| Canonical SMILES |
CC(C)Oc1cc(OC2CCN(C)CC2)c2c(Nc3c4OCOc4ccc3Cl)ncnc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H27ClN4O4/c1-14(2)32-16-10-18-21(20(11-16)33-15-6-8-29(3)9-7-15)24(27-12-26-18)28-22-17(25)4-5-19-23(22)31-13-30-19/h4-5,10-12,14-15H,6-9,13H2,1-3H3,(H,26,27,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HWFNAHQNQARBKY-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