Molecule Info: CHEMBL201945
Smiles:
O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CC[C@]2(CC1)OCc1c2cccc1
InChIKey:
MAKMQGKJURAJEN-FGMFOJHFNA-N
InChI:
1/C27H35N3O2/c31-26(25-12-6-17-30(25)20-22-8-2-1-3-9-22)28-15-7-16-29-18-13-27(14-19-29)24-11-5-4-10-23(24)21-32-27/h1-5,8-11,25H,6-7,12-21H2,(H,28,31)/t25-/m1/s1/f/h28H
InChIcol:
1
More information (from its Standard Form):
CHEMBL201945
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.
Image of the Specific State
