| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2005 | 19 | Yes |
Popular Name: MELPERONE HYDROCHLORIDE MELPERONE HYDROCHLORIDE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1622-79-3 , 3575-80-2 , [1622-79-3]
1-(4-fluorophenyl)-4-(4-methylpiperidin-1-yl)butan-1-one
1-(4-Fluorophenyl)-4-(4-methylpiperidin-1-yl)butan-1-one hydrochloride
1-(4-Fluorophenyl)-4-(4-methylpiperidin-1-yl)butan-1-onehydrochloride
1622-79-3; Buronil (TN); D08172; Melperone hydrochloride
3575-80-2; Bunil (TN); D07309; Melperone (INN)
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.34 | 10.41 | -42.03 | 1 | 2 | 1 | 22 | 264.364 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_SUBSTANCE_COMMENT | NCC_SAMPLE_SUPPLIER : Tocris Cookson Ltd.; NCC_SUPPLIER_STRUCTURE_ID : 100740; 1 hydrogen chloride | NIH Clinical Collection via PubChem |
| therap | neuroleptic, 5HT/2a antagonist | MicroSource World Drugs |
| PUBCHEM_SUBSTANCE_COMMENT | SAMPLE_SUPPLIER: Tocris Bioscience; SUPPLIER_STRUCTURE_ID: 100740; SALT: 1 hydrogen chloride | NIH Clinical Collection via PubChem |
No pre-computed analogs available. Try a structural similarity search.