General Information of the Compound
| Compound ID |
CP0328239
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-fluoro-2-(1H-imidazol-5-ylmethyl)-3,4-dihydro-1H-[1]benzothiolo[2,3-c]pyridine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H14FN3S
|
||||||||||||||||||
| Molecular Weight |
287.363
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc2sc3CN(Cc4c[nH]cn4)CCc3c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H14FN3S/c16-10-1-2-14-13(5-10)12-3-4-19(8-15(12)20-14)7-11-6-17-9-18-11/h1-2,5-6,9H,3-4,7-8H2,(H,17,18)
Show/Hide
|
||||||||||||||||||
| InChIKey |
LTAXPWDTMINWRK-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