General Information of the Compound
| Compound ID |
CP0383074
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1,3,10-trichloro-7-(3,5-dichloro-4-hydroxy-2-methoxy-6-methylphenyl)-2,4,6,9-tetrahydroxy-12,12-dimethyltetracen-5-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H19Cl5O7
|
||||||||||||||||||
| Molecular Weight |
644.718
|
||||||||||||||||||
| Canonical SMILES |
COc1c(Cl)c(O)c(Cl)c(C)c1-c1cc(O)c(Cl)c2cc3c(C(=O)c4c(O)c(Cl)c(O)c(Cl)c4C3(C)C)c(O)c12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H19Cl5O7/c1-7-12(27(40-4)21(33)25(38)17(7)29)8-6-11(34)18(30)9-5-10-14(22(35)13(8)9)23(36)15-16(28(10,2)3)19(31)26(39)20(32)24(15)37/h5-6,34-35,37-39H,1-4H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
YLKIGAKGYRJIBR-UHFFFAOYSA-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