General Information of the Compound
| Compound ID |
CP0378630
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[5-[3,5-bis(trifluoromethyl)phenyl]-1-[[3-(trifluoromethyl)phenyl]methyl]indol-3-yl]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H17F9N2O
|
||||||||||||||||||
| Molecular Weight |
544.417
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)Cc1cn(Cc2cccc(c2)C(F)(F)F)c2ccc(cc12)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H17F9N2O/c27-24(28,29)18-3-1-2-14(6-18)12-37-13-17(10-23(36)38)21-9-15(4-5-22(21)37)16-7-19(25(30,31)32)11-20(8-16)26(33,34)35/h1-9,11,13H,10,12H2,(H2,36,38)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SHSSYMNRRKGVOH-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