General Information of the Compound
| Compound ID |
CP0181683
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-(2-(benzo[d][1,3]dioxol-5-yl)-9H-purin-6-yl)morpholine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H15N5O3
|
||||||||||||||||||
| Molecular Weight |
325.328
|
||||||||||||||||||
| Canonical SMILES |
C1Oc2ccc(cc2O1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H15N5O3/c1-2-11-12(24-9-23-11)7-10(1)14-19-15-13(17-8-18-15)16(20-14)21-3-5-22-6-4-21/h1-2,7-8H,3-6,9H2,(H,17,18,19,20)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HWVQDXXMHUAOHV-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