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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
  • PhysProp
http://linked.open...ank/propertyValue
  • 2
  • 0
  • 1
  • 9
  • -2.6
  • -4.71
  • 34 °C
  • -0.055
  • 117.08
  • 1,1,1-trifluoro-3-(octylsulfanyl)propan-2-one
  • 194.1939
  • N-[(1S,7Z,13S,27S)-18-[(1E)-4-hydroxy-2-methylbut-1-en-1-yl]-22-[(1Z)-4-hydroxy-2-methylbut-1-en-1-yl]-8-methyl-12,29,31-trioxo-11,19λ³,21λ³,32,33,34λ³,35-heptaoxa-5,17,23,28,30-pentaaza-20-ferrahexacyclo[25.2.2.1⁵,²⁰.1⁶,²⁰.1¹⁷,²⁰.1²⁰,²³]pentatriaconta-6(34),7,18,21-tetraen-13-yl]acetamide
  • CCCCCCCCCCCCCCCC=O
  • InChIKey=OHWCFZJEIHZWMN-ZCFIWIBFSA-N
  • NC1=CNC(=O)NC1=O
  • C[C@](O)(COC1=C(F)C(F)=C(F)C(F)=C1F)C(=O)NC1=CC=C(C(=C1)C(F)(F)F)[N+]([O-])=O
  • InChI=1S/C13H19BClN2O6/c1-8(18)17-12(6-9-2-4-10(15)5-3-9)14(21,22)23-7-11(16)13(19)20/h2-5,11-12,21-22H,6-7,16H2,1H3,(H,17,18)(H,19,20)/q-1/t11-,12+/m0/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...y/drugbank/SMILES of
is http://linked.open...ogy/drugbank/logP of
is http://linked.open...ogy/drugbank/logS of
is http://linked.open...-Bond-Donor-Count of
is http://linked.open...drugbank/InChIKey of
is http://linked.open...bank/Refractivity of
is http://linked.open...atable-Bond-Count of
is http://linked.open...aco2-Permeability of
is http://linked.open...nk/MDDR-Like-Rule of
is http://linked.open...ank/Melting-Point of
is http://linked.open...k/Number-of-Rings of
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