About: http://linked.opendata.cz/resource/drugbank/property/271B535E-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
  • MANNHOLD,R ET AL. (1990)
http://linked.open...ank/propertyValue
  • 0
  • 1
  • 23
  • 0.07
  • 1.84
  • 3.78
  • -3.7
  • 83.83
  • 9.98
  • (2R)-2-[(4-{[(2S)-2-[(2-carboxyethyl)carbamoyl]pyrrolidin-1-yl]sulfonyl}phenyl)formamido]pentanedioic acid
  • 155.1943
  • 3.22e-04 g/l
  • 444.998411434
  • 570.7566
  • CC(CCC1=CC=CC=C1)NCC(O)C1=CC(C(N)=O)=C(O)C=C1
  • InChIKey=JDBSITHMKSTORG-FLRLBIABSA-N
  • InChIKey=ZLZXUNHJWVLGTE-DLBZAZTESA-N
  • InChI=1S/C19H23N3O4S/c1-18(2)13(17(25)26)21-15(24)12(16(21)27-18)22-14(23)11(20-19(22,3)4)10-8-6-5-7-9-10/h5-9,11-13,16,20H,1-4H3,(H,25,26)/t11-,12-,13+,16-/m1/s1
is http://linked.open...ugbank/IUPAC-Name of
is http://linked.open...gy/drugbank/InChI of
is http://linked.open.../Molecular-Weight 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/logP of
is http://linked.open...ogy/drugbank/logS of
is http://linked.open...nd-Acceptor-Count of
is http://linked.open...drugbank/InChIKey of
is http://linked.open...bank/Refractivity of
is http://linked.open...k/Bioavailability of
is http://linked.open...bank/Rule-of-Five of
is http://linked.open...strongest-acidic- of
is http://linked.open...-strongest-basic- of
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