General Information of the Compound
| Compound ID |
CP0549284
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8829200, 9
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H24N10O
|
||||||||||||||||||
| Molecular Weight |
468.525
|
||||||||||||||||||
| Canonical SMILES |
CNC(=O)c1ccc(cc1-c1nc2cc(ccc2n1C(C)(C)C)-c1cnc(N)nc1)-c1nn[nH]n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H24N10O/c1-24(2,3)34-19-8-6-13(15-11-27-23(25)28-12-15)10-18(19)29-21(34)17-9-14(20-30-32-33-31-20)5-7-16(17)22(35)26-4/h5-12H,1-4H3,(H,26,35)(H2,25,27,28)(H,30,31,32,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CXDOYFDQZNMNSF-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