General Information of the Compound
| Compound ID |
CP0544953
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(9,10-Dihydro-anthracen-9-ylmethyl)-trimethyl-ammonium
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H22N+
|
||||||||||||||||||
| Molecular Weight |
252.381
|
||||||||||||||||||
| Canonical SMILES |
C[N+](C)(C)CC1c2ccccc2Cc2ccccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H22N/c1-19(2,3)13-18-16-10-6-4-8-14(16)12-15-9-5-7-11-17(15)18/h4-11,18H,12-13H2,1-3H3/q+1
Show/Hide
|
||||||||||||||||||
| InChIKey |
XQPVDYZHVQVGKP-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