General Information of the Compound
| Compound ID |
CP0952406
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(2-Aminoethyl)-N-methyl-4'-(morpholin-4-yl)biphenyl-3-carboxamide (2R,3R)-tartrate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H31N3O8
|
||||||||||||||||||
| Molecular Weight |
489.525
|
||||||||||||||||||
| Canonical SMILES |
CN(CCN)C(=O)c1cccc(-c2ccc(N3CCOCC3)cc2)c1.O=C(O)[C@H](O)[C@@H](O)C(=O)O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H25N3O2.C4H6O6/c1-22(10-9-21)20(24)18-4-2-3-17(15-18)16-5-7-19(8-6-16)23-11-13-25-14-12-23;5-1(3(7)8)2(6)4(9)10/h2-8,15H,9-14,21H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
YVLFARFBXDSJPJ-LREBCSMRSA-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