Compound Summary
Aldometanib
Compound Information
Aldometanib
Compound Name: | Aldometanib |
Compound CID: | 165413044 |
Synonyms: | Aldometanib HY-148189 CS-0615373 More... |
Iupac Name: | 1-[(2,6-dichlorophenyl)methyl]-3-hexadecyl-2-methylimidazol-1-ium;iodide |
InChI: | InChI=1S/C27H43Cl2N2.HI/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-30-21-22-31(24(30)2)23-25-26(28)18-17-19-27(25)29;/h17-19,21-22H,3-16,20,23H2,1-2H3;1H/q+1;/p-1 |
InChIKey: | QGSVKLIYXRLMTB-UHFFFAOYSA-M |
Canonical Smiles: | CCCCCCCCCCCCCCCCN1C=C[N+](=C1C)CC2=C(C=CC=C2Cl)Cl.[I-] |
Isomeric Smiles: | CCCCCCCCCCCCCCCCN1C=C[N+](=C1C)CC2=C(C=CC=C2Cl)Cl.[I-] |
Molecular Weight: | 593.5 |
Molecular Formula: | C27H43Cl2IN2 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Aldometanib
Molecular Weight: | 593.5 |
Molecular Formula: | C27H43Cl2IN2 |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 1 |
Rotatable Bond Count: | 17 |
Heavy Atom Count: | 32 |
Complexity: | 424 |
Synonyms
Aldometanib
| Aldometanib | Aldometanib |
|---|---|
Aldometanib |
HY-148189 |
CS-0615373 |
Experimental Data
Aldometanib
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | 100.000000000000000 | ug/mL | 788.684000000000000 | 841.994000000000000 | 0.070000000000000 | S | C57BL/6 | MALES | 36217034 | Active | |||
| Caenorhabditis elegans | 5.000000000000000 | umol/L | 19.149000000000000 | 20.334000000000000 | 0.060000000000000 | S | N2 | 36217034 | Active | ||||
| Caenorhabditis elegans | 25.000000000000000 | umol/L | 19.149000000000000 | 22.248000000000000 | 0.160000000000000 | S | N2 | 36217034 | Active | ||||
| Mus musculus | 100.000000000000000 | ug/mL | 778.463000000000000 | 855.856000000000000 | 0.100000000000000 | S | C57BL/6 | FEMALES | 36217034 | Active | |||
| Caenorhabditis elegans | 2.000000000000000 | umol/L | 19.149000000000000 | 19.620000000000000 | 0.020000000000000 | NS | N2 | 36217034 | Inactive | ||||
| Caenorhabditis elegans | 50.000000000000000 | umol/L | 19.149000000000000 | 21.558000000000000 | 0.130000000000000 | S | N2 | 36217034 | Active | ||||
| Caenorhabditis elegans | 10.000000000000000 | umol/L | 19.149000000000000 | 25.364000000000000 | 0.320000000000000 | S | N2 | 36217034 | Active | ||||
| Caenorhabditis elegans | 1.000000000000000 | umol/L | 19.149000000000000 | 19.335000000000000 | 0.010000000000000 | NS | N2 | 36217034 | Inactive | ||||
| Caenorhabditis elegans | 12.500000000000000 | umol/L | 19.149000000000000 | 24.350000000000000 | 0.270000000000000 | S | N2 | 36217034 | Active |
Experimental Data Visualization
Aldometanib
Statistics Data
Aldometanib
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 0.320000000000000 | 1 | 7 | |
| Mus musculus | 0.100000000000000 | 1 | 2 |
Statistics Data Visualization
Aldometanib
