General Information of the Compound
| Compound ID |
CP0377567
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]-5-pyridin-2-yl-1,2,4-triazol-3-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H26N8O3
|
||||||||||||||||||
| Molecular Weight |
462.514
|
||||||||||||||||||
| Canonical SMILES |
COc1cc2c(ncnc2cc1OCCCN1CCOCC1)-n1nc(nc1N)-c1ccccn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H26N8O3/c1-32-19-13-16-18(14-20(19)34-10-4-7-30-8-11-33-12-9-30)26-15-27-22(16)31-23(24)28-21(29-31)17-5-2-3-6-25-17/h2-3,5-6,13-15H,4,7-12H2,1H3,(H2,24,28,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
WOBNGAPCPQOALX-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