General Information of the Compound
| Compound ID |
CP0962821
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
trans-2-(3-Chlorophenyl)-N'-((8-methoxyquinolin-6-yl)methylene)cyclopropanecarbohydrazide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H18ClN3O2
|
||||||||||||||||||
| Molecular Weight |
379.847
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(/C=N/NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)cc2cccnc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H18ClN3O2/c1-27-19-9-13(8-15-5-3-7-23-20(15)19)12-24-25-21(26)18-11-17(18)14-4-2-6-16(22)10-14/h2-10,12,17-18H,11H2,1H3,(H,25,26)/b24-12+/t17-,18+/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
RCQIXGLASLTZQE-BCEARJSMSA-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