About: http://linked.opendata.cz/resource/drugbank/property/271B5224-363D-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
  • HANSCH,C ET AL. (1995)
http://linked.open...ank/propertyValue
  • 0
  • 1
  • 11
  • 4
  • 0.89
  • -3.2
  • C3H8O2
  • CC(=O)N[C@@H](CC1=CC=C(OCC(O)=O)C(=C1)P(O)(O)=O)C(=O)N[C@@H]1CCCCN(CC2=CC=C(C=C2)C2=CC=CC=C2)C1=O
  • (2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxane-2-carboxamide
  • InChIKey=AULMJMUNCOBRHC-HBNTYKKESA-N
  • InChIKey=CPVRYQAOUPSUDO-UHFFFAOYSA-N
  • [H][C@]12CC[C@]([H])([C@H]([C@@H](O)C1)C(O)=O)N2C
  • [H][C@@]1(CO[C@@](C)(OC1)C(O)=O)OC(=O)N1CCN(CC1)C(=O)O[C@@]1([H])CO[C@](C)(OC1)C(O)=O
  • 1-(5-carboxypentyl)-5-[(2,6-dichlorophenyl)methoxy]-1H-indole-2-carboxylic acid
is http://linked.open...ugbank/IUPAC-Name of
is http://linked.open...Molecular-Formula of
is http://linked.open...y/drugbank/SMILES of
is http://linked.open...ogy/drugbank/logP of
is http://linked.open...nd-Acceptor-Count of
is http://linked.open...-Bond-Donor-Count of
is http://linked.open...drugbank/InChIKey of
is http://linked.open...bank/Ghose-Filter of
is http://linked.open...k/Number-of-Rings of
is http://linked.open...siological-Charge of
is http://linked.open...tional-IUPAC-Name of
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