General Information of the Compound
| Compound ID |
CP0187050
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(1H-indol-4-yloxy)-3-(pentan-3-ylamino)propan-2-ol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H24N2O2
|
||||||||||||||||||
| Molecular Weight |
276.38
|
||||||||||||||||||
| Canonical SMILES |
CCC(CC)NCC(O)COc1cccc2[nH]ccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H24N2O2/c1-3-12(4-2)18-10-13(19)11-20-16-7-5-6-15-14(16)8-9-17-15/h5-9,12-13,17-19H,3-4,10-11H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
KPSXOWDYMRQPSA-UHFFFAOYSA-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