General Information of the Compound
| Compound ID |
CP0574773
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(3-phenylsulfanylpropyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazole
Show/Hide
|
||||||||||||||||||
| Formula |
C19H21N3S
|
||||||||||||||||||
| Molecular Weight |
323.465
|
||||||||||||||||||
| Canonical SMILES |
C(CSc1ccccc1)CN1CCn2c(C1)nc1ccccc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H21N3S/c1-2-7-16(8-3-1)23-14-6-11-21-12-13-22-18-10-5-4-9-17(18)20-19(22)15-21/h1-5,7-10H,6,11-15H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
DUCNLOGLGVMEDA-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 | |||||||||||||||||||
| 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