General Information of the Compound
| Compound ID |
CP0567874
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(4-methoxyphenyl)-5,7,17,19-tetraoxa-13-azahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-1(24),2,4(8),9,15(23),16(20),21-heptaen-14-imine
Show/Hide
|
||||||||||||||||||
| Formula |
C26H20N2O5
|
||||||||||||||||||
| Molecular Weight |
440.455
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)\N=c1/n2CCc3cc4OCOc4cc3-c2cc2ccc3OCOc3c12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H20N2O5/c1-29-18-5-3-17(4-6-18)27-26-24-16(2-7-21-25(24)33-14-30-21)10-20-19-12-23-22(31-13-32-23)11-15(19)8-9-28(20)26/h2-7,10-12H,8-9,13-14H2,1H3/b27-26-
Show/Hide
|
||||||||||||||||||
| InChIKey |
YDXOIOVNSAFQQF-RQZHXJHFSA-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 | |||||||||||||||||||
| 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