General Information of the Compound
| Compound ID |
CP0567596
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2S,5R)-5-(3-phenylmethoxyphenyl)pyrrolidine-2-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H20N2O2
|
||||||||||||||||||
| Molecular Weight |
296.37
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)[C@@H]1CC[C@@H](N1)c1cccc(OCc2ccccc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H20N2O2/c19-18(21)17-10-9-16(20-17)14-7-4-8-15(11-14)22-12-13-5-2-1-3-6-13/h1-8,11,16-17,20H,9-10,12H2,(H2,19,21)/t16-,17+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
JLHKAVZBPMWOMO-SJORKVTESA-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