General Information of the Compound
| Compound ID |
CP0440026
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2-[benzyl-[(1-methyl-4H-chromeno[4,3-c]pyrazol-3-yl)methyl]amino]ethyl]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H26N4O2
|
||||||||||||||||||
| Molecular Weight |
390.487
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)NCCN(Cc1nn(C)c-2c1COc1ccccc-21)Cc1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H26N4O2/c1-17(28)24-12-13-27(14-18-8-4-3-5-9-18)15-21-20-16-29-22-11-7-6-10-19(22)23(20)26(2)25-21/h3-11H,12-16H2,1-2H3,(H,24,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
GODKJEVZMVSWLA-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