General Information of the Compound
| Compound ID |
CP0568815
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-1-yl)-2-[6-[4-(4-ethylpiperazin-1-yl)phenyl]-4-fluoroindazol-2-yl]-N-(1,3-thiazol-2-yl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H31FN8OS
|
||||||||||||||||||
| Molecular Weight |
570.698
|
||||||||||||||||||
| Canonical SMILES |
CCN1CCN(CC1)c1ccc(cc1)-c1cc(F)c2cn(nc2c1)C(C(=O)Nc1nccs1)c1ncn2CCCc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H31FN8OS/c1-2-36-11-13-37(14-12-36)22-7-5-20(6-8-22)21-16-24(31)23-18-39(35-25(23)17-21)28(29(40)34-30-32-9-15-41-30)27-26-4-3-10-38(26)19-33-27/h5-9,15-19,28H,2-4,10-14H2,1H3,(H,32,34,40)
Show/Hide
|
||||||||||||||||||
| InChIKey |
DBJAEJWIJXPDTI-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 | |||||||||||||||||||
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