General Information of the Compound
| Compound ID |
CP0887695
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(bis(2-fluorophenyl)(hydroxy)methyl)-1-(2-hydroxyethyl)-1H-benzo[d]imidazole-6-sulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H19F2N3O4S
|
||||||||||||||||||
| Molecular Weight |
459.474
|
||||||||||||||||||
| Canonical SMILES |
NS(=O)(=O)c1ccc2nc(C(O)(c3ccccc3F)c3ccccc3F)n(CCO)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H19F2N3O4S/c23-17-7-3-1-5-15(17)22(29,16-6-2-4-8-18(16)24)21-26-19-10-9-14(32(25,30)31)13-20(19)27(21)11-12-28/h1-10,13,28-29H,11-12H2,(H2,25,30,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FATXCIJIEXCKEM-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