General Information of the Compound
| Compound ID |
CP0524555
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-[6-(phenylcarbamoylamino)purin-9-yl]oxolane-2-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H21N7O5
|
||||||||||||||||||
| Molecular Weight |
427.421
|
||||||||||||||||||
| Canonical SMILES |
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC(=O)Nc3ccccc3)ncnc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H21N7O5/c1-2-20-17(29)14-12(27)13(28)18(31-14)26-9-23-11-15(21-8-22-16(11)26)25-19(30)24-10-6-4-3-5-7-10/h3-9,12-14,18,27-28H,2H2,1H3,(H,20,29)(H2,21,22,24,25,30)/t12-,13+,14-,18+/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
UXZYHNCJLXSIKZ-MOROJQBDSA-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