General Information of the Compound
| Compound ID |
CP0181858
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[4-[6-methyl-8-[[3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-yl]amino]imidazo[1,2-a]pyrazin-3-yl]pyrazol-1-yl]-N-phenylacetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H31N9OS
|
||||||||||||||||||
| Molecular Weight |
541.685
|
||||||||||||||||||
| Canonical SMILES |
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4ccccc4)c3)sn2)C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H31N9OS/c1-19-7-6-10-35(14-19)17-23-11-26(39-34-23)33-27-28-29-13-24(37(28)15-20(2)31-27)21-12-30-36(16-21)18-25(38)32-22-8-4-3-5-9-22/h3-5,8-9,11-13,15-16,19H,6-7,10,14,17-18H2,1-2H3,(H,31,33)(H,32,38)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JJOKOLOYQZIVJV-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