About: http://linked.opendata.cz/resource/drugbank/property/271B4344-363D-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
  • PhysProp
http://linked.open...ank/propertyValue
  • 2
  • 0
  • 1
  • 1.45
  • 2.94
  • -1.9
  • -2.1
  • 46.53
  • 172-174 °C
  • 88.61
  • CCC1=C(C)NC(=O)C(I)=C1OC1=CC=CC(\C=C\C#N)=C1
  • InChIKey=XBPZXDSZHPDXQU-UHFFFAOYSA-N
  • ethyl (2E,4S)-4-[(2S)-2-[(2S)-2-[(2S)-2-(furan-3-ylformamido)-3-methylbutanamido]-3-methylbutanamido]-4-methylpentanamido]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate
  • 1-(isopropylamino)-3-[4-(2-methoxyethyl)phenoxy]propan-2-ol
is http://linked.open...ugbank/IUPAC-Name 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...urface-Area--PSA- of
is http://linked.open...ank/Melting-Point of
is http://linked.open...k/Number-of-Rings of
is http://linked.open...siological-Charge of
is http://linked.open...bank/Rule-of-Five of
is http://linked.open...tional-IUPAC-Name of
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