General Information of the Compound
| Compound ID |
CP0555338
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8653100, 15
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H30ClFN2O3S
|
||||||||||||||||||
| Molecular Weight |
481.033
|
||||||||||||||||||
| Canonical SMILES |
CCCS(=O)(=O)NCCOc1cc2C(NCCc2cc1F)C1(CCC1)c1ccc(Cl)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H30ClFN2O3S/c1-2-14-32(29,30)28-12-13-31-22-16-20-17(15-21(22)26)8-11-27-23(20)24(9-3-10-24)18-4-6-19(25)7-5-18/h4-7,15-16,23,27-28H,2-3,8-14H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
LEHDJJSKQYYJKX-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