| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2008 | 25 | Yes |
Popular Name: Prochlorperazine Prochlorperazine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1215641-01-2 , 1257-78-9 , 1257-78-9, 84-02-6 , 1257-78-9, 84-02-6 [prochlorperazine maleate], 58-38-8 [prochlorperazine] , 51888-09-6 , 58-38-8 , 84-02-6 , [1257-78-9]
10H-Phenothiazine, 2-chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-
10H-Phenothiazine, 2-chloro-10-[3-(4-methyl-1-piperazinyl)propyl- [CAS]; CPD000466275; SAM001247054
10H-Phenothiazine, 2-chloro-10-[3-(4-methyl-1-piperazinyl)propyl]-
1257-78-9; Compazine syrup (TN); D02609; Prochlorperazine edisylate (USP)
2-Chloro-10-(3-(1-methyl-4-piperazinyl)propyl)-phenothiazine
2-Chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-10H-phenothiazine
2-Chloro-10-(3-(4-methyl-1-piperazinyl)propyl)phenothiazine
2-Chloro-10-[3-(4-methyl-1-piper- azinyl)propyl]-10H-pheno-thiazine dimaleate
2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]-10H-phenothiazine
2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine
3-Chloro-10-(3-(1-methyl-4-piperazinyl)propyl)phenothiazine
3-Chloro-10-(3-(4-methyl-1-piperazinyl)propyl)phenothiazine
58-38-8; C07403; Prochlorperazine
84-02-6; Prestwick_410; Prochlorperazine dimaleate
Chloro-3 (N-methylpiperazinyl-3 propyl)-10 phenothiazine
Chloro-3 (N-methylpiperazinyl-3 propyl)-10 phenothiazine [French]
CPD000466275; 10H-Phenothiazine, 2-chloro-10-[3-(4-methyl-1-piperazinyl)propyl- [CAS]
N-(gamma-(4'-Methylpiperazinyl-1')propyl)-3-chlorophenothiazine
Phenothiazine, 2-chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-
Prochlorperazine (JAN/USP/INN)
Prochlorperazine dihydrobromide
Prochlorperazine Edisylate Salt
Prochlorperazine [USAN:INN:BAN:JAN]
prochlorperazine; prochlorperazinum; proclorperazina
USP); Prochlorperazine Maleate (FDA
USP); Prochlorperazine Mesilate (JAN); Prochlorperazine Edisylate (FDA
| 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) | 4.92 | 10.95 | -38.86 | 1 | 3 | 1 | 13 | 374.961 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.92 | 8.58 | -5.48 | 0 | 3 | 0 | 11 | 373.953 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.92 | 10.83 | -44.39 | 1 | 3 | 1 | 13 | 374.961 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 1.10e-02 g/l | DrugBank-approved |
| therap | antiemetic, antipsychotic, treatment of vertigo | MicroSource Spectrum |
| Therapy | Antipsychotic agent; used in the treatment of spastic gastrointestinal disorders | SMDC Iconix |
| Patent Database Links | EP1181933; EP1604658; EP1627639; EP1754712; EP1815846; EP1829527; EP1829528; EP1839648; EP1990046; EP1990639; US2005080075; US2006063753; US2006135511; US2006148790; US2006199798; US2007185018; US2007203119; US2007225379; US2007258894; US2007259952; US200 | ChEBI |
| Patent Database Links | EP1604658; EP1829534; US2007185018 | ChEBI |
| PUBCHEM_SUBSTANCE_COMMENT | NCC_SAMPLE_SUPPLIER : Tocris Cookson Ltd.; NCC_SUPPLIER_STRUCTURE_ID : 101287; 2 maleic acid | NIH Clinical Collection via PubChem |
| PUBCHEM_SUBSTANCE_COMMENT | SAMPLE_SUPPLIER: Tocris Bioscience; SUPPLIER_STRUCTURE_ID: 101287; SALT: 2 maleic acid | NIH Clinical Collection via PubChem |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PDR5-1-F | Pleiotropic ABC Efflux Transporter Of Multiple Drugs (cluster #1 Of 1), Fungal | Fungi | 1700 | 0.32 | Binding ≤ 10μM |
| Z50425-2-O | Plasmodium Falciparum (cluster #2 Of 22), Other | Other | 3981 | 0.30 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PDR5_YEAST | P33302 | Pleiotropic ABC Efflux Transporter Of Multiple Drugs, Yeast | 1700 | 0.32 | Binding ≤ 10μM |
| Z50425 | Z50425 | Plasmodium Falciparum | 10000 | 0.28 | Functional ≤ 10μM |
