23312 <common-name>Cycrimine</common-name> <description nil="true"/> <cas>77-39-4</cas> <pubchem-id>2911</pubchem-id> <chemical-formula>C19H29NO</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">2016-05-25T18:23:50Z</created-at> <updated-at type="dateTime">2026-05-14T16:53:37Z</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>DB00942</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>OC(CCN1CCCCC1)(C1CCCC1)C1=CC=CC=C1</moldb-smiles> <moldb-formula>C19H29NO</moldb-formula> <moldb-inchi>InChI=1S/C19H29NO/c21-19(18-11-5-6-12-18,17-9-3-1-4-10-17)13-16-20-14-7-2-8-15-20/h1,3-4,9-10,18,21H,2,5-8,11-16H2</moldb-inchi> <moldb-inchikey>SWRUZBWLEWHWRI-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">287.4397</moldb-average-mass> <moldb-mono-mass type="decimal">287.224914555</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.79</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>2808</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>CHEM022207</chemdb-id> <dsstox-id>DTXSID50861769</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00041059</susdat-id> <iupac>1-cyclopentyl-1-phenyl-3-(piperidin-1-yl)propan-1-ol</iupac> <moldb-polar-surface-area>23.47</moldb-polar-surface-area> <moldb-refractivity>88.60420000000003</moldb-refractivity> <moldb-polarizability>34.783554719779175</moldb-polarizability> <moldb-rotatable-bond-count>5</moldb-rotatable-bond-count> <moldb-acceptor-count>2</moldb-acceptor-count> <moldb-donor-count>1</moldb-donor-count> <moldb-pka-strongest-acidic>13.840029634547864</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>9.322450553606162</moldb-pka-strongest-basic> <moldb-physiological-charge>1</moldb-physiological-charge> <moldb-number-of-rings>3</moldb-number-of-rings> <moldb-alogps-logp>4.15</moldb-alogps-logp> <moldb-alogps-logs>-4.50</moldb-alogps-logs> <moldb-alogps-solubility>9.09e-03 g/l</moldb-alogps-solubility> </compound>