General Information of the Compound
| Compound ID |
CP0897128
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
7-(2-(2-(6-bromobenzo[d][1,3]dioxol-5-yl)vinyl)hydrazinyl)-N-hydroxy-7-oxoheptanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H20BrN3O5
|
||||||||||||||||||
| Molecular Weight |
414.256
|
||||||||||||||||||
| Canonical SMILES |
O=C(CCCCCC(=O)NN/C=C/c1cc2c(cc1Br)OCO2)NO
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H20BrN3O5/c17-12-9-14-13(24-10-25-14)8-11(12)6-7-18-19-15(21)4-2-1-3-5-16(22)20-23/h6-9,18,23H,1-5,10H2,(H,19,21)(H,20,22)/b7-6+
Show/Hide
|
||||||||||||||||||
| InChIKey |
HXAKCNRDWDSHIL-VOTSOKGWSA-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