General Information of the Compound
| Compound ID |
CP0559887
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-{4-[(3-Chloro-4-hydroxy-benzoyl)-hydrazonomethyl]-indol-1-yl}-N,N-diethyl-acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H23ClN4O3
|
||||||||||||||||||
| Molecular Weight |
426.904
|
||||||||||||||||||
| Canonical SMILES |
CCN(CC)C(=O)Cn1ccc2c(\C=N\NC(=O)c3ccc(O)c(Cl)c3)cccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H23ClN4O3/c1-3-26(4-2)21(29)14-27-11-10-17-16(6-5-7-19(17)27)13-24-25-22(30)15-8-9-20(28)18(23)12-15/h5-13,28H,3-4,14H2,1-2H3,(H,25,30)/b24-13+
Show/Hide
|
||||||||||||||||||
| InChIKey |
SDWCCUHKTHMBKN-ZMOGYAJESA-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