General Information of the Compound
| Compound ID |
CP0392882
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
8-hydroxy-5-[(1S)-2-hydroxy-1-[2-(4-hydroxyphenyl)ethylamino]ethyl]-1H-quinolin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H20N2O4
|
||||||||||||||||||
| Molecular Weight |
340.379
|
||||||||||||||||||
| Canonical SMILES |
OC[C@@H](NCCc1ccc(O)cc1)c1ccc(O)c2[nH]c(=O)ccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H20N2O4/c22-11-16(20-10-9-12-1-3-13(23)4-2-12)14-5-7-17(24)19-15(14)6-8-18(25)21-19/h1-8,16,20,22-24H,9-11H2,(H,21,25)/t16-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
NDRIGQZTNSODTO-MRXNPFEDSA-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