General Information of the Compound
| Compound ID |
CP0948220
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(bis(2-fluorophenyl)(hydroxy)methyl)-1-ethyl-N-(2-hydroxyethyl)-1H-benzo[d]imidazole-6-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H23F2N3O3
|
||||||||||||||||||
| Molecular Weight |
451.473
|
||||||||||||||||||
| Canonical SMILES |
CCn1c(C(O)(c2ccccc2F)c2ccccc2F)nc2ccc(C(=O)NCCO)cc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H23F2N3O3/c1-2-30-22-15-16(23(32)28-13-14-31)11-12-21(22)29-24(30)25(33,17-7-3-5-9-19(17)26)18-8-4-6-10-20(18)27/h3-12,15,31,33H,2,13-14H2,1H3,(H,28,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JSNSZGHPSCHSQD-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