Compound Summary
MDL 26,630 trihydrochloride
Compound Information
MDL 26,630 trihydrochloride
Compound Name: | MDL 26,630 trihydrochloride |
Compound CID: | 11957639 |
Synonyms: | MDL 26,630 trihydrochloride 2-6-(2-aminoethyl)piperidin-2-ylethanamine EU-0100834 mdl-26,630-trihydrochloride CHEMBL1590722 More... |
Iupac Name: | 2-[6-(2-aminoethyl)piperidin-2-yl]ethanamine;trihydrochloride |
InChI: | InChI=1S/C9H21N3.3ClH/c10-6-4-8-2-1-3-9(12-8)5-7-11;;;/h8-9,12H,1-7,10-11H2;3*1H |
InChIKey: | UFVMPKORWRHRNF-UHFFFAOYSA-N |
Canonical Smiles: | C1CC(NC(C1)CCN)CCN.Cl.Cl.Cl |
Isomeric Smiles: | C1CC(NC(C1)CCN)CCN.Cl.Cl.Cl |
Molecular Weight: | 280.7 |
Molecular Formula: | C9H24Cl3N3 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
MDL 26,630 trihydrochloride
Molecular Weight: | 280.7 |
Molecular Formula: | C9H24Cl3N3 |
Hydrogen Bond Donor Count: | 6 |
Hydrogen Bond Acceptor Count: | 3 |
Rotatable Bond Count: | 4 |
Heavy Atom Count: | 15 |
Complexity: | 104 |
Synonyms
MDL 26,630 trihydrochloride
| MDL 26,630 trihydrochloride | MDL 26,630 trihydrochloride |
|---|---|
MDL 26,630 trihydrochloride |
2-6-(2-aminoethyl)piperidin-2-ylethanamine |
EU-0100834 |
mdl-26,630-trihydrochloride |
CHEMBL1590722 |
DTXSID601018967 |
Tox21_500834 |
LP00834 |
NCGC00094165-01 |
NCGC00261519-01 |
M-166 |
SR-01000075178 |
SR-01000075178-1 |
Experimental Data
MDL 26,630 trihydrochloride
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33.000000000000000 | umol/L | 5.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
MDL 26,630 trihydrochloride
Statistics Data
MDL 26,630 trihydrochloride
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 5.000000000000000 | 1 | 1 |
Statistics Data Visualization
MDL 26,630 trihydrochloride
