<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">21015</id>
  <title nil="true"/>
  <common-name>Clindamycin phosphate</common-name>
  <description nil="true"/>
  <cas>24729-96-2</cas>
  <pubchem-id>10346039</pubchem-id>
  <chemical-formula>C18H34ClN2O8PS</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">2016-05-22T06:37:21Z</created-at>
  <updated-at type="dateTime">2026-03-27T02:00:47Z</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 nil="true"/>
  <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(C)(Cl)C([H])(N=C(O)[C@]1([H])C[C@@]([H])(CCC)CN1C)[C@@]1([H])O[C@]([H])(SC)[C@]([H])(OP(O)(O)=O)[C@@]([H])(O)[C@@]1([H])O</moldb-smiles>
  <moldb-formula>C18H34ClN2O8PS</moldb-formula>
  <moldb-inchi>InChI=1S/C18H34ClN2O8PS/c1-5-6-10-7-11(21(3)8-10)17(24)20-12(9(2)19)15-13(22)14(23)16(18(28-15)31-4)29-30(25,26)27/h9-16,18,22-23H,5-8H2,1-4H3,(H,20,24)(H2,25,26,27)/t9?,10-,11+,12?,13-,14+,15-,16-,18-/m1/s1</moldb-inchi>
  <moldb-inchikey>UFUVLHLTWXBHGZ-KUWMELJBSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">504.963</moldb-average-mass>
  <moldb-mono-mass type="decimal">504.146200983</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>8521497</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>CHEM019910</chemdb-id>
  <dsstox-id>DTXSID1048677</dsstox-id>
  <toxcast-id>48677</toxcast-id>
  <stoff-ident-origin>UBA</stoff-ident-origin>
  <stoff-ident-id>SI00005350</stoff-ident-id>
  <susdat-id>NS00008079</susdat-id>
  <iupac nil="true"/>
  <moldb-polar-surface-area>152.28</moldb-polar-surface-area>
  <moldb-refractivity>117.11189999999999</moldb-refractivity>
  <moldb-polarizability>49.56736571902587</moldb-polarizability>
  <moldb-rotatable-bond-count>9</moldb-rotatable-bond-count>
  <moldb-acceptor-count>9</moldb-acceptor-count>
  <moldb-donor-count>5</moldb-donor-count>
  <moldb-pka-strongest-acidic>0.44816892548312204</moldb-pka-strongest-acidic>
  <moldb-pka-strongest-basic>6.78324268308646</moldb-pka-strongest-basic>
  <moldb-physiological-charge>-1</moldb-physiological-charge>
  <moldb-number-of-rings>2</moldb-number-of-rings>
  <moldb-alogps-logp>0.95</moldb-alogps-logp>
  <moldb-alogps-logs>-2.20</moldb-alogps-logs>
  <moldb-alogps-solubility>3.22e+00 g/l</moldb-alogps-solubility>
</compound>
