General Information of the Compound
| Compound ID |
CP0553141
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-(4-chlorophenyl)-2-(2-methylindazol-5-yl)-6-(2,2,2-trifluoroethoxy)pyrido[3,2-c]pyridazin-3-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H15ClF3N5O2
|
||||||||||||||||||
| Molecular Weight |
485.853
|
||||||||||||||||||
| Canonical SMILES |
Cn1cc2cc(ccc2n1)-n1nc2ccc(OCC(F)(F)F)nc2c(-c2ccc(Cl)cc2)c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H15ClF3N5O2/c1-31-11-14-10-16(6-7-17(14)29-31)32-22(33)20(13-2-4-15(24)5-3-13)21-18(30-32)8-9-19(28-21)34-12-23(25,26)27/h2-11H,12H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
MZZJRVUNJOCVMT-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