About: http://linked.opendata.cz/resource/drugbank/property/271B4317-363D-11E5-9242-09173F13E4C5     Goto   Sponge   NotDistinct   Permalink

An Entity of Type : owl:Thing, within Data Space : linked.opendata.cz associated with source document(s)

AttributesValues
http://linked.open...nk/propertySource
  • ALOGPS
  • ChemAxon
http://linked.open...ank/propertyValue
  • 2
  • 0
  • 8.77
  • Fica
  • -0.13
  • -1.9
  • -3.2
  • -6.9
  • 12.9
  • 2.40e-03 g/l
  • C4H9NO3
  • 4-{[1-methyl-2,4-dioxo-6-(3-phenylprop-1-yn-1-yl)-1,2,3,4-tetrahydroquinazolin-3-yl]methyl}benzoic acid
  • 328.167459256
  • InChIKey=RUOKEQAAGRXIBM-GFCCVEGCSA-N
  • InChIKey=XMFJTCGUDFSWSW-INIZCTEOSA-N
  • CCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](O)C(C)(C)CO[P@](O)(=O)O[P@@](O)(=O)OC[C@@H]1O[C@H]([C@H](O)[C@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N
is http://linked.open...ugbank/IUPAC-Name of
is http://linked.open...Molecular-Formula of
is http://linked.open...noisotopic-Weight of
is http://linked.open...y/drugbank/SMILES of
is http://linked.open.../Water-Solubility of
is http://linked.open...ogy/drugbank/logS of
is http://linked.open...drugbank/InChIKey of
is http://linked.open...atable-Bond-Count of
is http://linked.open...bank/Ghose-Filter of
is http://linked.open...siological-Charge of
is http://linked.open...tional-IUPAC-Name of
is http://linked.open...strongest-acidic- of
is http://linked.open...-strongest-basic- of
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