General Information of the Compound
| Compound ID |
CP0547336
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
[(1R)-2-(1-benzofuran-3-yl)-1-[[(3R)-oxolane-3-carbonyl]amino]ethyl]boronic acid
Show/Hide
|
||||||||||||||||||
| Formula |
C15H18BNO5
|
||||||||||||||||||
| Molecular Weight |
303.123
|
||||||||||||||||||
| Canonical SMILES |
OB(O)[C@H](Cc1coc2ccccc12)NC(=O)[C@@H]1CCOC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H18BNO5/c18-15(10-5-6-21-8-10)17-14(16(19)20)7-11-9-22-13-4-2-1-3-12(11)13/h1-4,9-10,14,19-20H,5-8H2,(H,17,18)/t10-,14+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
LPDJLONKZFUKOX-YGRLFVJLSA-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