General Information of the Compound
| Compound ID |
CP0572938
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(4-chlorophenyl)-4-oxo-N-(2-phenylethyl)phthalazine-1-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H18ClN3O2
|
||||||||||||||||||
| Molecular Weight |
403.869
|
||||||||||||||||||
| Canonical SMILES |
Clc1ccc(cc1)-n1nc(C(=O)NCCc2ccccc2)c2ccccc2c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H18ClN3O2/c24-17-10-12-18(13-11-17)27-23(29)20-9-5-4-8-19(20)21(26-27)22(28)25-15-14-16-6-2-1-3-7-16/h1-13H,14-15H2,(H,25,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
MGURWGPNOBGQKK-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 | |||||||||||||||||||
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