General Information of the Compound
| Compound ID |
CP0359353
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(4-isopropylpiperazin-1-yl)(3-(morpholinomethyl)-1H-indol-7-yl)methanone
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H30N4O2
|
||||||||||||||||||
| Molecular Weight |
370.497
|
||||||||||||||||||
| Canonical SMILES |
CC(C)N1CCN(CC1)C(=O)c1cccc2c(CN3CCOCC3)c[nH]c12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H30N4O2/c1-16(2)24-6-8-25(9-7-24)21(26)19-5-3-4-18-17(14-22-20(18)19)15-23-10-12-27-13-11-23/h3-5,14,16,22H,6-13,15H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
IVNCNRBMLXEETI-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