PDB CCD ID: | SNP |
Number of entries in BioLiP: | 8 |
Chemical formula: | C16 H21 N O2 |
InChI: | InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3/t14-/m0/s1 |
InChIKey: | AQHHHDLHHXJYJD-AWEZNQCLSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.341 | CC(C)NC[CH](O)COc1cccc2ccccc12 | OpenEye OEToolkits 1.5.0 | CC(C)NC[C@@H](COc1cccc2c1cccc2)O | CACTVS 3.341 | CC(C)NC[C@H](O)COc1cccc2ccccc12 | OpenEye OEToolkits 1.5.0 | CC(C)NCC(COc1cccc2c1cccc2)O | ACDLabs 10.04 | OC(CNC(C)C)COc2cccc1ccccc12 |
|
Name: | 1-(ISOPROPYLAMINO)-3-(1-NAPHTHYLOXY)-2-PROPANOL; S-PROPRANOLOL |
ChEMBL: | CHEMBL452861 |
ZINC: | ZINC000000056556 |