General Information of the Compound
| Compound ID |
CP0554210
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8822510, 19
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H26ClN5O4
|
||||||||||||||||||
| Molecular Weight |
507.978
|
||||||||||||||||||
| Canonical SMILES |
Clc1ccc(cc1)C1(COCc2nc(no2)-c2ccc(CN3CC4(C3)NC(=O)NC4=O)cc2)CCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H26ClN5O4/c27-20-8-6-19(7-9-20)25(10-1-11-25)16-35-13-21-28-22(31-36-21)18-4-2-17(3-5-18)12-32-14-26(15-32)23(33)29-24(34)30-26/h2-9H,1,10-16H2,(H2,29,30,33,34)
Show/Hide
|
||||||||||||||||||
| InChIKey |
PNXFPHPTKJLANH-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