General Information of the Compound
| Compound ID |
CP0544721
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US10047103, 195
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H16F2N4O2S2
|
||||||||||||||||||
| Molecular Weight |
494.548
|
||||||||||||||||||
| Canonical SMILES |
C[C@H](F)c1nn2cc(nc2s1)-c1cc2c(OCc3csc(n3)-c3ccccc3)cc(F)cc2o1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H16F2N4O2S2/c1-13(25)22-29-30-10-18(28-24(30)34-22)21-9-17-19(7-15(26)8-20(17)32-21)31-11-16-12-33-23(27-16)14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3/t13-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
GSJFSQJHCJBDIN-ZDUSSCGKSA-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