General Information of the Compound
| Compound ID |
CP0406728
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2R)-1-(2-methyl-1-(naphthalen-2-yl)propan-2-ylamino)-3-(1-(pyridin-2-yl)ethoxy)propan-2-ol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H30N2O2
|
||||||||||||||||||
| Molecular Weight |
378.516
|
||||||||||||||||||
| Canonical SMILES |
CC(OC[C@H](O)CNC(C)(C)Cc1ccc2ccccc2c1)c1ccccn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H30N2O2/c1-18(23-10-6-7-13-25-23)28-17-22(27)16-26-24(2,3)15-19-11-12-20-8-4-5-9-21(20)14-19/h4-14,18,22,26-27H,15-17H2,1-3H3/t18?,22-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
NPVKQRBIYIVQQU-LMNIDFBRSA-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