About: http://linked.opendata.cz/resource/drugbank/property/271B5439-363D-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
  • ADME Research, USCD
  • ALOGPS
  • ChemAxon
  • TOMLIN,C (1997); pKa1
http://linked.open...ank/propertyValue
  • 0
  • 1
  • 18
  • 3
  • 1.77
  • 3.1
  • 4.98
  • -4.46
  • 1-phenyl-1H-pyrazole-4-carboxylic acid
  • CCCCCC(CCCCC)SC1=C(N=NN1)C(O)=O
  • InChIKey=LCAHPIFLPICNRW-SVYNMNNPSA-N
  • NCCCCNCCCN
  • [H][C@@]12CC3=CC=C(OC4=C5C(CC[N+](C)(C)[C@]5([H])CC5=CC(OC6=C(OC)C=C(CCN1C)C2=C6)=C(O)C=C5)=CC(OC)=C4O)C=C3
  • 4-hydroxy-3-{[(3S)-2-oxo-3-{thieno[3,2-b]pyridine-2-sulfonamido}pyrrolidin-1-yl]methyl}benzene-1-carboximidamide
  • thenoyltrifluoroacetone
  • InChI=1S/C12H9F2O5P/c13-12(14,20(17,18)19)10-4-3-7-5-9(11(15)16)2-1-8(7)6-10/h1-6H,(H,15,16)(H2,17,18,19)
is http://linked.open...ugbank/IUPAC-Name of
is http://linked.open...gy/drugbank/InChI of
is http://linked.open...y/drugbank/SMILES of
is http://linked.open...ogy/drugbank/logP of
is http://linked.open...ogy/drugbank/logS of
is http://linked.open...logy/drugbank/pKa of
is http://linked.open...nd-Acceptor-Count 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...nk/MDDR-Like-Rule of
is http://linked.open...bank/Rule-of-Five of
is http://linked.open...tional-IUPAC-Name of
is http://linked.open...-strongest-basic- of
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