InsectiPAD(Insecticide Physicochemical-properties Analysis Database) is a special agrochemical database to not only provide information on all approved insecticides but also qualitative and quantitative evaluate insecticide-likeness of small molecules. This website also allows you to compute physicochemical descriptors and insecticide-likeness scores of any small molecule to support agrochemical discovery.

You can browse structures and physicochemical properties of these molecules directly in the Browse page, click ID-link to view more basic information(common name, IUPAC name, CAS number, smiles, inchi), physicochemical properties(MW, ALogP, AMR, nAromBond, CLogS, TopoPSA, nHBAcc, nHBDon etc.), qualitative analysis of the distribution of molecular physicochemical properties and quantitative analysis of insecticide-likeness scores.

Insecticides can be retrieved through both a text-based keyword search and a structure-based similarity search. For text-based search, insecticides match the keywords will be showed. You can also refine your search by choosing some specific physicochemical characteristics for the compounds. For structure-based search, insecticide with similar structure with your input structure will be presented. 

The input is an user-defined structure generated by JSME. Your selected compounds with related physicochemical properties, bioavailability radars(the pink area represents the optimal range for each properties) and insecticide-likeness scores will be showed in a few minute. The higher the score, the better the insecticide-likeness of your compounds.

visits since Dec 4th,2017