2.8.2 ADME prediction
In a drug design point of view the ADME (absorption, distribution,
metabolism, and excretion) properties of the newly found compound,
Phormidin, compared to the standard, Cerulenin and C75 were predicted
using the Schrödinger suite’s Qikprop module (QikProp, version 3.5,
Schrödinger, LLC, New York,). Also, Qikprop can predict ADME of any
possible drug leads by comparing the compound scaffold with known
database and analyzing its similarity within a class of compounds
(Schrödinger Release 2015: QikProp, Schrödinger, LLC, New York, NY,
2016.).