Molecule Info: SB-674042
Smiles:
Cc1sc(c(n1)C(=O)N1CCC[C@H]1Cc1nnc(o1)c1ccccc1)c1ccccc1F


InChIKey:
HYBZWVLPALMACV-KRWDZBQONA-N

InChI:
1/C24H21FN4O2S/c1-15-26-21(22(32-15)18-11-5-6-12-19(18)25)24(30)29-13-7-10-17(29)14-20-27-28-23(31-20)16-8-3-2-4-9-16/h2-6,8-9,11-12,17H,7,10,13-14H2,1H3/t17-/m0/s1

InChIcol:
1

+info (from its Standard Form):
SB-674042

Complex structures in which this molecule appears :
Complex Structure ID: 188

References in which this molecule is mentioned:

National Center for Biotechnology Information. PubChem Compound Database. None. Information for this molecule was obtained via PubChem API and RDKit tools. None None (None). doi: None.


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: