23232 <common-name>Carteolol</common-name> <description nil="true"/> <cas>51781-06-7</cas> <pubchem-id>2583</pubchem-id> <chemical-formula>C16H24N2O3</chemical-formula> <weight nil="true"/> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2016-05-25T18:21:00Z</created-at> <updated-at type="dateTime">2026-05-14T16:41:05Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id>DB00521</drugbank-id> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>CC(C)(C)NCC(O)COC1=CC=CC2=C1CCC(=O)N2</moldb-smiles> <moldb-formula>C16H24N2O3</moldb-formula> <moldb-inchi>InChI=1S/C16H24N2O3/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20)</moldb-inchi> <moldb-inchikey>LWAFSWPYPHEXKX-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">292.3734</moldb-average-mass> <moldb-mono-mass type="decimal">292.178692644</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.42</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>2485</chemspider-id> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM022127</chemdb-id> <dsstox-id>DTXSID3022746</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00007545</susdat-id> <iupac>5-[3-(tert-butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydroquinolin-2-one</iupac> <moldb-polar-surface-area>70.59</moldb-polar-surface-area> <moldb-refractivity>83.14160000000003</moldb-refractivity> <moldb-polarizability>32.789724060000694</moldb-polarizability> <moldb-rotatable-bond-count>6</moldb-rotatable-bond-count> <moldb-acceptor-count>4</moldb-acceptor-count> <moldb-donor-count>3</moldb-donor-count> <moldb-pka-strongest-acidic>13.408521242479178</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>9.75944617220637</moldb-pka-strongest-basic> <moldb-physiological-charge>1</moldb-physiological-charge> <moldb-number-of-rings>2</moldb-number-of-rings> <moldb-alogps-logp>1.05</moldb-alogps-logp> <moldb-alogps-logs>-2.84</moldb-alogps-logs> <moldb-alogps-solubility>4.21e-01 g/l</moldb-alogps-solubility> </compound>