General Information of the Compound
| Compound ID |
CP0351967
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl)benzene-1,3-diol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H16N4O4
|
||||||||||||||||||
| Molecular Weight |
364.361
|
||||||||||||||||||
| Canonical SMILES |
Oc1cc(O)cc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H16N4O4/c24-12-8-11(9-13(25)10-12)17-21-15-14-2-1-3-20-19(14)27-16(15)18(22-17)23-4-6-26-7-5-23/h1-3,8-10,24-25H,4-7H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
XGGJRXOHVXJAGB-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
Protein ID: PT01045, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform