19436 <common-name>Pivampicillin</common-name> <description nil="true"/> <cas>33817-20-8</cas> <pubchem-id>33478</pubchem-id> <chemical-formula>C22H29N3O6S</chemical-formula> <weight>463.5</weight> <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">2016-05-22T05:09:43Z</created-at> <updated-at type="dateTime">2026-08-21T22:49:00Z</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>DB01604</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>[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@H](N)C1=CC=CC=C1)C(=O)OCOC(=O)C(C)(C)C</moldb-smiles> <moldb-formula>C22H29N3O6S</moldb-formula> <moldb-inchi>InChI=1S/C22H29N3O6S/c1-21(2,3)20(29)31-11-30-19(28)15-22(4,5)32-18-14(17(27)25(15)18)24-16(26)13(23)12-9-7-6-8-10-12/h6-10,13-15,18H,11,23H2,1-5H3,(H,24,26)/t13-,14-,15+,18-/m1/s1</moldb-inchi> <moldb-inchikey>ZEMIJUDPLILVNQ-ZXFNITATSA-N</moldb-inchikey> <moldb-average-mass type="decimal">463.547</moldb-average-mass> <moldb-mono-mass type="decimal">463.177706365</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.07</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>30899</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>CHEM018331</chemdb-id> <dsstox-id>DTXSID1045459</dsstox-id> <toxcast-id>45459</toxcast-id> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00007431</susdat-id> <iupac>[(2S,5R,6R)-6-[(2R)-2-amino-2-phenylacetamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyloxy]methyl 2,2-dimethylpropanoate</iupac> <moldb-polar-surface-area>128.03</moldb-polar-surface-area> <moldb-refractivity>116.24830000000001</moldb-refractivity> <moldb-polarizability>47.53968324049653</moldb-polarizability> <moldb-rotatable-bond-count>9</moldb-rotatable-bond-count> <moldb-acceptor-count>5</moldb-acceptor-count> <moldb-donor-count>2</moldb-donor-count> <moldb-pka-strongest-acidic>11.707929021475366</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>7.438306945693415</moldb-pka-strongest-basic> <moldb-physiological-charge>1</moldb-physiological-charge> <moldb-number-of-rings>3</moldb-number-of-rings> <moldb-alogps-logp>1.43</moldb-alogps-logp> <moldb-alogps-logs>-4.12</moldb-alogps-logs> <moldb-alogps-solubility>3.54e-02 g/l</moldb-alogps-solubility> </compound>