General Information of the Compound
| Compound ID |
CP0271222
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-N-(3,4-dichlorophenyl)piperazine-1-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H26Cl2N4O2
|
||||||||||||||||||
| Molecular Weight |
413.349
|
||||||||||||||||||
| Canonical SMILES |
Clc1ccc(NC(=O)N2CCN(C[C@H]3CN(CCO3)C3CC3)CC2)cc1Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H26Cl2N4O2/c20-17-4-1-14(11-18(17)21)22-19(26)24-7-5-23(6-8-24)12-16-13-25(9-10-27-16)15-2-3-15/h1,4,11,15-16H,2-3,5-10,12-13H2,(H,22,26)/t16-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
IXACLKNSEGSKGF-INIZCTEOSA-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