General Information of the Compound
| Compound ID |
CP0309959
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
AZD0530 analogue 17
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H32N4O5
|
||||||||||||||||||
| Molecular Weight |
492.576
|
||||||||||||||||||
| Canonical SMILES |
C(CN1CCCC1)Oc1cc(OC2CCOCC2)c2c(Nc3cccc4OCCOc34)ncnc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H32N4O5/c1-2-9-31(8-1)10-13-33-20-16-22-25(24(17-20)36-19-6-11-32-12-7-19)27(29-18-28-22)30-21-4-3-5-23-26(21)35-15-14-34-23/h3-5,16-19H,1-2,6-15H2,(H,28,29,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
MNYUDSXBPUCGII-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