General Information of the Compound
| Compound ID |
CP0377384
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(2-(3-(4-benzoylpiperazin-1-yl)-2-hydroxypropoxy)phenyl)-3-phenylpropan-1-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H32N2O4
|
||||||||||||||||||
| Molecular Weight |
472.585
|
||||||||||||||||||
| Canonical SMILES |
OC(COc1ccccc1C(=O)CCc1ccccc1)CN1CCN(CC1)C(=O)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H32N2O4/c32-25(21-30-17-19-31(20-18-30)29(34)24-11-5-2-6-12-24)22-35-28-14-8-7-13-26(28)27(33)16-15-23-9-3-1-4-10-23/h1-14,25,32H,15-22H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
JDHYTLQRORSYBS-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