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Predicted properties of the compound entered.

ID AAXWBCKQYLBQKY-IRXDYDNUSA-N
Formula C21H27N5O5
IUPAC Name (2S)-2-[(2S)-3-(1H-imidazol-4-yl)-2-[2-(phenylformamido)acetamido]propanamido]-4-methylpentanoic acid
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C21H27N5O5/c1-13(2)8-17(21(30)31)26-20(29)16(9-15-10-22-12-24-15)25-18(27)11-23-19(28)14-6-4-3-5-7-14/h3-7,10,12-13,16-17H,8-9,11H2,1-2H3,(H,22,24)(H,23,28)(H,25,27)(H,26,29)(H,30,31)/t16-,17-/m0/s1
Standard InChIKey (User Input) InChIKey=AAXWBCKQYLBQKY-IRXDYDNUSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers (2S)-2-[[(2S)-2-[[2-(benzoylamino)acetyl]amino]-3-(3H-imidazol-4-yl)propanoyl]amino]-4-methylpentanoic acid | (2S)-2-[[(2S)-2-[[2-(benzoylamino)acetyl]amino]-3-(3H-imidazol-4-yl)propanoyl]amino]-4-methyl-pentanoic acid | (2S)-2-[[(2S)-3-(3H-imidazol-4-yl)-1-oxo-2-[[1-oxo-2-[(oxo-phenylmethyl)amino]ethyl]amino]propyl]amino]-4-methylpentanoic acid | (2S)-2-[[(2S)-2-[[2-(benzoylamino)acetyl]amino]-3-(3H-imidazol-4-yl)propanoyl]amino]-4-methyl-valeric acid | (2S)-2-[[(2S)-3-(3H-imidazol-4-yl)-2-[2-(phenylcarbonylamino)ethanoylamino]propanoyl]amino]-4-methyl-pentanoic acid | EINECS 250-597-9 | Hippuryl-histidyl-leucine | N-(N-(N-Benzoylglycyl)-L-histidyl)-L-leucine | H1635_SIGMA
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Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
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Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
Upper Flammability Limit Volume Percent - - -
Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -
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