General Information of the Compound
| Compound ID |
CP0327823
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US10597366, Compound 25
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H10ClF4NO4S
|
||||||||||||||||||
| Molecular Weight |
411.76
|
||||||||||||||||||
| Canonical SMILES |
O[C@H]1c2c(CC1(F)F)c(Oc1cncc(Cl)c1)ccc2S(=O)(=O)C(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H10ClF4NO4S/c16-7-3-8(6-21-5-7)25-10-1-2-11(26(23,24)14(17)18)12-9(10)4-15(19,20)13(12)22/h1-3,5-6,13-14,22H,4H2/t13-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
BHVVNKUTBLIFBF-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