General Information of the Compound
| Compound ID |
CP0442504
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-ethylbenzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H25ClN2O
|
||||||||||||||||||
| Molecular Weight |
344.886
|
||||||||||||||||||
| Canonical SMILES |
CCc1ccccc1C(=O)N[C@@H](CCN(C)C)c1ccc(Cl)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H25ClN2O/c1-4-15-7-5-6-8-18(15)20(24)22-19(13-14-23(2)3)16-9-11-17(21)12-10-16/h5-12,19H,4,13-14H2,1-3H3,(H,22,24)/t19-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZOQZOOMQYNYVEP-IBGZPJMESA-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