General Information of the Compound
| Compound ID |
CP0856492
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[3-(2-{[4-(1,4'-bipiperidin-1'-yl)-2-(methyloxy)phenyl]amino}-4-pyrimidinyl)-8-methylimidazo[1,2-a]pyridin-2-yl]-N-(2,6-difluorophenyl)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C42H42F2N8O2
|
||||||||||||||||||
| Molecular Weight |
728.848
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(N2CCC(N3CCCCC3)CC2)ccc1Nc1nccc(-c2c(-c3cccc(C(=O)Nc4c(F)cccc4F)c3)nc3c(C)cccn23)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C42H42F2N8O2/c1-27-9-8-22-52-39(37(48-40(27)52)28-10-6-11-29(25-28)41(53)49-38-32(43)12-7-13-33(38)44)35-16-19-45-42(47-35)46-34-15-14-31(26-36(34)54-2)51-23-17-30(18-24-51)50-20-4-3-5-21-50/h6-16,19,22,25-26,30H,3-5,17-18,20-21,23-24H2,1-2H3,(H,49,53)(H,45,46,47)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UBOMQCYIODMCTQ-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: PT01101, Insulin receptor
Protein ID: PT01104, Insulin-like growth factor 1 receptor