General Information of the Compound
| Compound ID |
CP0526054
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
11-methyl-6,11-dihydrothiochromeno[4,3-b]indole-3,8-diol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H13NO2S
|
||||||||||||||||||
| Molecular Weight |
283.352
|
||||||||||||||||||
| Canonical SMILES |
Cn1c-2c(CSc3cc(O)ccc-23)c2cc(O)ccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H13NO2S/c1-17-14-5-3-9(18)6-12(14)13-8-20-15-7-10(19)2-4-11(15)16(13)17/h2-7,18-19H,8H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
NYSGKUPOBGXTGU-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