General Information of the Compound
| Compound ID |
CP0573181
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[[4-(cyclopropylsulfonylmethyl)-2-(trifluoromethyl)phenyl]methyl]-1-(oxetan-3-ylmethyl)indole-5-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H25F3N2O4S
|
||||||||||||||||||
| Molecular Weight |
506.546
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)c1cc(CS(=O)(=O)C2CC2)ccc1CNC(=O)c1ccc2n(CC3COC3)ccc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H25F3N2O4S/c26-25(27,28)22-9-16(15-35(32,33)21-4-5-21)1-2-20(22)11-29-24(31)19-3-6-23-18(10-19)7-8-30(23)12-17-13-34-14-17/h1-3,6-10,17,21H,4-5,11-15H2,(H,29,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HJQDFOLVXFVQLW-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 | |||||||||||||||||||
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