General Information of the Compound
| Compound ID |
CP0919963
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(2,5-Dihydroxy-benzylamino)-2-hydroxy-benzoic acid hexadecyl ester
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H45NO5
|
||||||||||||||||||
| Molecular Weight |
499.692
|
||||||||||||||||||
| Canonical SMILES |
CCCCCCCCCCCCCCCCOC(=O)c1cc(NCc2cc(O)ccc2O)ccc1O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H45NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-36-30(35)27-22-25(16-18-29(27)34)31-23-24-21-26(32)17-19-28(24)33/h16-19,21-22,31-34H,2-15,20,23H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
NZIWPHUUCYWGLO-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