General Information of the Compound
| Compound ID |
CP0575063
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(S)-1-(2-cyclopropyl-4-(2-methylpyridin-4-yl)phenoxy)-2,4-dimethylpentan-2-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H30N2O
|
||||||||||||||||||
| Molecular Weight |
338.495
|
||||||||||||||||||
| Canonical SMILES |
CC(C)C[C@](C)(N)COc1ccc(cc1C1CC1)-c1ccnc(C)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H30N2O/c1-15(2)13-22(4,23)14-25-21-8-7-18(12-20(21)17-5-6-17)19-9-10-24-16(3)11-19/h7-12,15,17H,5-6,13-14,23H2,1-4H3/t22-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
OWZSSTHDQSTULI-QFIPXVFZSA-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 | |||||||||||||||||||
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