General Information of the Compound
| Compound ID |
CP0902691
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
trans-N'-(3,4-Dimethoxybenzylidene)-2-(quinolin-2-yl)cyclopropanecarbohydrazide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H21N3O3
|
||||||||||||||||||
| Molecular Weight |
375.428
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(/C=N/NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3n2)cc1OC
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H21N3O3/c1-27-20-10-7-14(11-21(20)28-2)13-23-25-22(26)17-12-16(17)19-9-8-15-5-3-4-6-18(15)24-19/h3-11,13,16-17H,12H2,1-2H3,(H,25,26)/b23-13+/t16-,17-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
MEFONATZMZLLEQ-FIUZQLGGSA-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