| Compound Information | SONAR Target prediction |
| Name: | ETHOSUXIMIDE |
| Unique Identifier: | SPE01502196 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | |
| Molecular Weight: | 130.08 g/mol |
| X log p: | -1.35 (online calculus) |
| Lipinksi Failures | 0 |
| TPSA | 34.14 |
| Hydrogen Bond Donor Count: | 0 |
| Hydrogen Bond Acceptors Count: | 3 |
| Rotatable Bond Count: | 1 |
| Canonical Smiles: | CCC1(C)CC(=O)NC1=O |
| Source: | synthetic |
| Therapeutics: | anticonvulsant |
| Generic_name: | Ethosuximide |
| Chemical_iupac_name: | 3-ethyl-3-methyl-pyrrolidine-2,5-dione |
| Drug_type: | Approved Drug |
| Pharmgkb_id: | PA449533 |
| Kegg_compound_id: | C07505 |
| Drugbank_id: | APRD00318 |
| Melting_point: | 64.5 oC |
| H2o_solubility: | 3.92E+004 mg/L |
| Logp: | 1.012 |
| Cas_registry_number: | 77-67-8 |
| Mass_spectrum: | http://webbook.nist.gov/cgi/cbook.cgi?Spec=C77678&Index=0&Type=Mass&Large=on |
| Drug_category: | Anticonvulsants; Succinimides; ATC:N03AD01 |
| Indication: | For the treatment of petit mal epilepsy. |
| Pharmacology: | Used in the treatment of epilepsy. Ethosuximide suppresses the paroxysmal three cycle per second spike and wave activity associated with lapses of consciousness which is common in absence (petit mal) seizures. The frequency of epileptiform attacks is reduced, apparently by depression of the motor cortex and elevation of the threshold of the central nervous system to convulsive stimuli. |
| Mechanism_of_action: | Binds to T-type voltage sensitive calcium channels. Voltage-sensitive calcium channels (VSCC) mediate the entry of calcium ions into excitable cells and are also involved in a variety of calcium-dependent processes, including muscle contraction, hormone or neurotransmitter release, gene expression, cell motility, cell division and cell death. The isoform alpha-1G gives rise to T-type calcium currents. T-type calcium channels belong to the "low-voltage activated (LVA)" group and are strongly blocked by mibefradil. A particularity of this type of channels is an opening at quite negative potentials and a voltage-dependent inactivation. T-type channels serve pacemaking functions in both central neurons and cardiac nodal cells and support calcium signaling in secretory cells and vascular smooth muscle. They may also be involved in the modulation of firing patterns of neurons which is important for information processing as well as in cell growth processes. |
| Organisms_affected: | Humans and other mammals |
| Found: 205 nonactive as graph: single | with analogs | 1 2 3 4 5 6 7 8 9 10 Next >> [205] |
| Species: | 4932 |
| Condition: | AAT2 |
| Replicates: | 2 |
| Raw OD Value: r im | 0.7156±0.0039598 |
| Normalized OD Score: sc h | 0.9749±0.000413835 |
| Z-Score: | -1.3358±0.00766254 |
| p-Value: | 0.18163 |
| Z-Factor: | -2.09289 |
| Fitness Defect: | 1.7058 |
| Bioactivity Statement: | Nonactive |
| ps |
| DBLink | Rows returned: 3 |
| 3291 | 3-ethyl-3-methyl-pyrrolidine-2,5-dione |
| 222690 | 3,3-diethylpyrrolidine-2,5-dione |
| 6603844 | (3R)-3-ethyl-3-methyl-pyrrolidine-2,5-dione |
| internal high similarity DBLink | Rows returned: 1 |
| LOPAC 00897 | 1.0000 |
| active | Cluster 5904 | Additional Members: 4 | Rows returned: 0 |
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