General Information of the Compound
| Compound ID |
CP0963412
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(3,4-dichlorophenyl)-7-{[(4-heptylmorpholin-2-yl)methyl]oxy}-6-(methyloxy)quinazolin-4-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H34Cl2N4O3
|
||||||||||||||||||
| Molecular Weight |
533.5
|
||||||||||||||||||
| Canonical SMILES |
CCCCCCCN1CCOC(COc2cc3ncnc(Nc4ccc(Cl)c(Cl)c4)c3cc2OC)C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H34Cl2N4O3/c1-3-4-5-6-7-10-33-11-12-35-20(16-33)17-36-26-15-24-21(14-25(26)34-2)27(31-18-30-24)32-19-8-9-22(28)23(29)13-19/h8-9,13-15,18,20H,3-7,10-12,16-17H2,1-2H3,(H,30,31,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OMTQJDUOTIRCBU-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