General Information of the Compound
| Compound ID |
CP0116040
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[6-amino-7-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]furo[3,2-c]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-sulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H19Cl2FN4O4S
|
||||||||||||||||||
| Molecular Weight |
501.367
|
||||||||||||||||||
| Canonical SMILES |
C[C@@H](Oc1c(N)ncc2c(coc12)C1=CCN(CC1)S(N)(=O)=O)c1c(Cl)ccc(F)c1Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H19Cl2FN4O4S/c1-10(16-14(21)2-3-15(23)17(16)22)31-19-18-12(8-26-20(19)24)13(9-30-18)11-4-6-27(7-5-11)32(25,28)29/h2-4,8-10H,5-7H2,1H3,(H2,24,26)(H2,25,28,29)/t10-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
SOFIJJPAHAAJKO-SNVBAGLBSA-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