Smiles:
O[C@H](COc1cccc2c1c1ccccc1[nH]2)C[NH2+]C(C)C

Netcharge:
1

InChIKey:
BQXQGZPYHWWCEB-VWCJKDHUNA-O

InChI:

1/C18H22N2O2/c1-12(2)19-10-13(21)11-22-17-9-5-8-16-18(17)14-6-3-4-7-15(14)20-16/h3-9,12-13,19-21H,10-11H2,1-2H3/p+1/t13-/m0/s1/fC18H23N2O2/h19H/q+1

InChIcol:
1

More information (from its Standard Form):

(S)-carazolol

Complex structures in which this molecule appears :

Complex Structure ID: 53 Complex Structure ID: 158

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