General Information of the Compound
| Compound ID |
CP0500309
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-bromo-N,N-dimethyl-9-(2,3,4-trifluorophenyl)sulfonyl-1,2,3,4-tetrahydrocarbazol-3-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H18BrF3N2O2S
|
||||||||||||||||||
| Molecular Weight |
487.341
|
||||||||||||||||||
| Canonical SMILES |
CN(C)C1CCc2c(C1)c1cc(Br)ccc1n2S(=O)(=O)c1ccc(F)c(F)c1F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H18BrF3N2O2S/c1-25(2)12-4-7-17-14(10-12)13-9-11(21)3-6-16(13)26(17)29(27,28)18-8-5-15(22)19(23)20(18)24/h3,5-6,8-9,12H,4,7,10H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
BYYSKUBHHAVRPY-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