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Compound InformationSONAR Target prediction
Name:

Promazine hydrochloride

Unique Identifier:LOPAC 01148
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C17ClH21N2S
Molecular Weight:299.714 g/mol
X log p:17.925  (online calculus)
Lipinksi Failures1
TPSA31.78
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:4
Canonical Smiles:Cl.CN(C)CCCN1c2ccccc2Sc2ccccc12
Class:Dopamine
Action:Antagonist
Selectivity:DRD2
Generic_name:Trimeprazine
Chemical_iupac_name:N,N,2-trimethyl-3-phenothiazin-10-yl-propan-1-amine
Drug_type:Approved Drug
Pharmgkb_id:PA451781
Kegg_compound_id:C07172
Drugbank_id:APRD00258
Melting_point:68 oC
H2o_solubility:0.942 mg/L
Logp:5.162
Isoelectric_point:9.05
Cas_registry_number:84-96-8
Mass_spectrum:http://webbook.nist.gov/cgi/cbook.cgi?Spec=C84968&Index=0&Type=Mass&Large=on
Drug_category:Antipruritics; Phenothiazine Derivatives; ATC:D04AA10; ATC:R06AD02; ATC:R06AD05
Indication:Used to prevent and relieve allergic conditions which cause pruritus (itching) and
urticaria (some allergic skin reactions).
Pharmacology:Trimeprazine (also known as Alimemazine) is a tricyclic antihistamine, similar in
structure to the phenothiazine antipsychotics, but differing in the
ring-substitution and chain characteristics. Trimeprazine is in the same class of
drugs as chlorpromazine (Thorazine) and trifluoperazine (Stelazine); however, unlike
the other drugs in this class, trimeprazine is not used clinically as an
anti-psychotic. It acts as an anti-histamine, a sedative, and an anti-emetic
(anti-nausea). Trimeprazine is used principally as an anti-emetic, to prevent motion
sickness or as an anti-histamine in combination with other medications in cough and
cold preparations. Tricyclic antihistamines are also structurally-related to the
tricyclic antidepressants, explaining the antihistaminergic adverse effects of these
two drug classes and also the poor tolerability profile of tricyclic
H1-antihistamines.
Mechanism_of_action:Trimeprazine competes with free histamine for binding at HA-receptor sites. This
antagonizes the effects of histamine on HA-receptors, leading to a reduction of the
negative symptoms brought on by histamine HA-receptor binding.
Organisms_affected:Humans and other mammals

Found: 24 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: DEP1
Replicates: 2
Raw OD Value: r im 0.6510±0.0579828
Normalized OD Score: sc h 0.9669±0.0305172
Z-Score: -1.3870±1.31472
p-Value: 0.333986
Z-Factor: -5.5532
Fitness Defect: 1.0967
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:13|A2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.90 Celcius
Date:2005-11-16 YYYY-MM-DD
Plate CH Control (+):0.039400000000000004±0.00165
Plate DMSO Control (-):0.6631750000000001±0.01992
Plate Z-Factor:0.9104
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DBLink | Rows returned: 12<< Back 1 2
212560 N,N,2,2-tetramethyl-3-phenothiazin-10-yl-propan-1-amine hydrochloride
450886 N,N-dimethyl-3-phenothiazin-10-yl-propan-1-amine
657285 N,N-dimethyl-3-phenothiazin-10-yl-propan-1-amine; hydrogen(+1) cation; chloride
5259899 dimethyl-(3-phenothiazin-10-ylpropyl)azanium
5458371 (2,2-dimethyl-3-phenothiazin-10-yl-propyl)-dimethyl-azanium chloride
6604496 (2S)-N,N,2-trimethyl-3-phenothiazin-10-yl-propan-1-amine

internal high similarity DBLink | Rows returned: 1
SPE01500509 1.0000

active | Cluster 17541 | Additional Members: 13 | Rows returned: 4
SPE01503934 0.32258064516129
SPE01500184 0
LAT005D03 0
LOPAC 00253 0

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