Smiles:
O=C(Nc1cccnc1Oc1ccccc1C(C)(C)C)Nc1ccc(cc1)OC(F)(F)F

InChIKey:
AHFLGPTXSIRAQK-LKHHGCNMNA-N

InChI:

1/C23H22F3N3O3/c1-22(2,3)17-7-4-5-9-19(17)31-20-18(8-6-14-27-20)29-21(30)28-15-10-12-16(13-11-15)32-23(24,25)26/h4-14H,1-3H3,(H2,28,29,30)/f/h28-29H

InChIcol:
1

More information (from its Standard Form):

BPTU

Complex structures in which this molecule appears :

Complex Structure ID: 209 Complex Structure ID: 210

References in which this molecule is mentioned:

Ismael Rodríguez-Espigares, Mariona Torrens-Fontanals, et al.. 2020. GPCRmd uncovers the dynamics of the 3D-GPCRome. Nature methods 17 (8). doi: 10.1038/s41592-020-0884-y.

Download the SDF file