General Information of the Compound
| Compound ID |
CP0481924
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US10058534, 26
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H18O5S
|
||||||||||||||||||
| Molecular Weight |
418.47
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)-c1sc2cc(O)ccc2c1Oc1ccc(\C=C\C(O)=O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H18O5S/c1-28-18-10-5-16(6-11-18)24-23(20-12-7-17(25)14-21(20)30-24)29-19-8-2-15(3-9-19)4-13-22(26)27/h2-14,25H,1H3,(H,26,27)/b13-4+
Show/Hide
|
||||||||||||||||||
| InChIKey |
JAWCHRNRHSJRGG-YIXHJXPBSA-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