ID: | 34 | |
---|---|---|
Name: | N-[2-[4-[[3-(tert-butylamino)pyridin-2-yl]-ethylamino]piperidine-1-carbonyl]-1H-indol-5-yl]methanesulfonamide | |
Description: | CHEMBL338979, chemical names origin from Pubchem, when ever possible systematic names are provided | |
Labels: | pyrrole, median_value | |
CAS: | 177577-60-5 | |
InChi Code: | InChI=1S/C26H36N6O3S/c1-6-32(24-22(8-7-13-27-24)29-26(2,3)4)20-11-14-31(15-12-20)25(33)23-17-18-16-19(30-36(5,34)35)9-10-21(18)28-23/h7-10,13,16-17,20,28-30H,6,11-12,14-15H2,1-5H3 |
pKi: Antiviral binding affinity equilibrium constant as p(Ki) [-log(mol/L)]
Value | Source or prediction |
---|---|
5.83 |
experimental value |
6.5388 |
Eq.1: Antiviral binding affinity for NNRTIs (validation) |