General Information of the Compound
| Compound ID |
CP0517596
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(4-cinnamoylpiperazin-1-yl)-5,7-dihydroxy-4-methyl-2H-chromen-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H22N2O5
|
||||||||||||||||||
| Molecular Weight |
406.438
|
||||||||||||||||||
| Canonical SMILES |
Cc1c(N2CCN(CC2)C(=O)\C=C\c2ccccc2)c(=O)oc2cc(O)cc(O)c12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H22N2O5/c1-15-21-18(27)13-17(26)14-19(21)30-23(29)22(15)25-11-9-24(10-12-25)20(28)8-7-16-5-3-2-4-6-16/h2-8,13-14,26-27H,9-12H2,1H3/b8-7+
Show/Hide
|
||||||||||||||||||
| InChIKey |
AHWLKLHCHKGPAS-BQYQJAHWSA-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