General Information of the Compound
| Compound ID |
CP0441560
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8987473, 175
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H8Cl3N7
|
||||||||||||||||||
| Molecular Weight |
380.626
|
||||||||||||||||||
| Canonical SMILES |
Clc1nn(Cc2c(Cl)cccc2Cl)c2cc(cnc12)-c1nnn[nH]1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H8Cl3N7/c15-9-2-1-3-10(16)8(9)6-24-11-4-7(14-19-22-23-20-14)5-18-12(11)13(17)21-24/h1-5H,6H2,(H,19,20,22,23)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SLNACHWZTKZDLX-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