General Information of the Compound
| Compound ID |
CP0272870
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9238644, 20
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H26ClN7O
|
||||||||||||||||||
| Molecular Weight |
451.962
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)C1(CC1)c1ccccc1CCc1nc(Nc2cnn(c2)C2CCNC2)ncc1Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H26ClN7O/c24-19-13-27-22(29-16-11-28-31(14-16)17-7-10-26-12-17)30-20(19)6-5-15-3-1-2-4-18(15)23(8-9-23)21(25)32/h1-4,11,13-14,17,26H,5-10,12H2,(H2,25,32)(H,27,29,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UMAZVUGSOHOIKQ-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: PT00864, Vascular endothelial growth factor receptor 2
Protein ID: PT00925, Vascular endothelial growth factor receptor 3