Experimental logP, logD, logS, pKa analysis

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• ONTOMINE - In silico bioactivity, adverse effect and toxicity screening for small molecules and metabolites
• ONTOMINE ADME - In silico models for logP, logD, logS, pKa

PhysChem StarterKit

Simple set of studies to reveal the aqueous solubility, Log D and pKa of NCEs. Minimal amount of a compound is needed. Used for hit molecule characterisation and to aid lead optimisation.

OptiSolv, LogD1to10, pKaDay, BindingPack, ChemStab

Dedicated studies for finding out properties of compounds. OptiSolv to study water solubility and optimal organic solvent; LogD1to10 to measure LogD from pH 1 to 10 in increments of one and including 6.5 and 7.4; pKaDay to measure pKa for about 25 compounds; BindingPack to study protein binding in up to eight species; and ChemStab to study chemical stability and identify degradation products.

Solubility 100, pKa 100 and LogD 100

Early-ADME physchem studies for 100 compounds to investigate aqueous solubility up to 1 mg/ml, pKa from 2.7 to 10.1 pH-units, and LogD between -3 and 3. Naturally, any other number of compounds can be studied as well.
Please follow this link to retrieve a detailed fact sheet of the Experimental logD service
Please follow this link to retrieve a detailed fact sheet of the Experimental solubility service