General Information of the Compound
| Compound ID |
CP0520555
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8993565, 150
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H20N4O4
|
||||||||||||||||||
| Molecular Weight |
344.371
|
||||||||||||||||||
| Canonical SMILES |
Cc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H20N4O4/c1-11-3-2-4-12(17(11)24)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-25-8-6-21/h2-4,10,24H,5-9H2,1H3,(H,18,22)(H,19,20,23)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CRIHIEAILJVYHK-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