Cheminformatic Tools and Databases for Pharmacology

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1 INNClassRoute (list)PK parameters= Cmax; Tmax; F: bioavailability; t1/2: half-life; VD: volume of distribution; Cl: clearance; PPB: plasma protein binding;(EQN means that value was calculated using VD=(Cl*t1/2)/0.693)Primary Target and PDB code of Protein-Drug complexTargets from DrugCentral Links
M DOXEPIN (is an active metabolite)

DOXEPIN


ATC N06AA12
ATC D04AX01

NERVOUS SYSTEM
ANTIDEPRESSANT
ANTI-ANXIETY AGENTS
TRICYCLIC PSYCHOTHERAPEUTIC AGENT
ANTI-PRURITIC
HISTAMINE RECEPTOR ANTAGONIST

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HT 31 HOUR

HISTAMINE H2 RECEPTOR
HISTAMINE H1 RECEPTOR

NOREPINEPHRINE TRANSPORTER INHIBITOR CHEMBL222 NOREPINEPHRINE TRANSPORTER P23975 SODIUM-DEPENDENT NORADRENALINE TRANSPORTER HOMO SAPIENS TRANSPORTER ELECTROCHEMICAL SLC SLC06EMA

ANSM (in French)

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SIDER side effects

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ChEMBL
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