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Found 1 result

Search term: PQOOIERVZAXHBP (Found by InChIKey (skeleton match))

ChemSpider 2D Image | UNC1215 | C32H43N5O2

UNC1215

  • Molecular FormulaC32H43N5O2
  • Average mass529.716 Da
  • Monoisotopic mass529.341675 Da
  • ChemSpider ID28475308

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2-Anilino-1,4-phenylen)bis{[4-(1-pyrrolidinyl)-1-piperidinyl]methanon} [German] [ACD/IUPAC Name]
(2-Anilino-1,4-phenylene)bis{[4-(1-pyrrolidinyl)-1-piperidinyl]methanone} [ACD/IUPAC Name]
(2-Anilino-1,4-phénylène)bis{[4-(1-pyrrolidinyl)-1-pipéridinyl]méthanone} [French] [ACD/IUPAC Name]
[2-Phenylamino-4-(4-pyrrolidin-1-yl-piperidine-1-carbonyl)-phenyl]-(4-pyrrolidin-1-yl-piperidin-1-yl)-methanone
1415800-43-9 [RN]
Methanone, 1,1'-[2-(phenylamino)-1,4-phenylene]bis[1-[4-(1-pyrrolidinyl)-1-piperidinyl]- [ACD/Index Name]
MFCD22683289
UNC1215
(2-(phenylamino)-1,4-phenylene)bis((4-(pyrrolidin-1-yl)piperidin-1-yl)methanone)
(2-?(PHENYLAMINO)-?1,?4-?PHENYLENE)BIS((4-?(PYRROLIDIN-?1-?YL)PIPERIDIN-?1-?YL)METHA)
More...

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]
PubChem Substance ID 329825761 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Safety:

      5 Axon Medchem 1994
      H303;H313;H317;H333;H334;H335;H373 Axon Medchem 1994
      no pictogram Axon Medchem 1994
      P101;P102;P103;P260;P262;P263;P264;P270;P280;P304;P312;P340 Axon Medchem 1994
      TBC SynQuest 4H48-1-PD
      This probe is supplied in conjunction with the Structural Genomics Consortium. For further characterization details, please visit the UNC 1215 probe summary on the SGC website. Tocris Bioscience 4666
      Warning Axon Medchem 1994
    • Target Organs:

      Epigenetic Reader Domain antagonist TargetMol T2379
    • Bio Activity:

      Cell Biology Tocris Bioscience 4666
      Cell Cycle/DNA Damage MedChem Express HY-15649
      Cell Cycle/DNA Damage; MedChem Express HY-15649
      Chromatin/Epigenetic TargetMol T2379
      Epigenetics Tocris Bioscience 4666
      HMTase MedChem Express HY-15649
      L3MBTL3; TargetMol T2379
      MBT Domains Tocris Bioscience 4666
      Potent inhibitor of L3MBTL3 Kme reader domain; cell permeable Tocris Bioscience 4666
      Potent inhibitor of L3MBTL3 methyllysine (Kme) reader domain (IC50 = 40 nM; Kd = 120 nM). Displays >100-fold selectivity over a panel of histone methyltransferases, kinases, ion channels and 7-TM rece ptors. Disrupts subnuclear localization and foci formation of fluorescently-labeled L3MBTL3 in HEK293 cells. Tocris Bioscience 4666
      Potent inhibitor of L3MBTL3 methyllysine (Kme) reader domain (IC50 = 40 nM; Kd = 120 nM). Displays >100-fold selectivity over a panel of histone methyltransferases, kinases, ion channels and 7-TM receptors. Disrupts subnuclear localization and foci formation of fluorescently-labeled L3MBTL3 in HEK293 cells. Tocris Bioscience 4666
      UNC1215 is a potent and selective chemical probe for the methyllysine (Kme) reading function of L3MBTL3 with Kd value of 120 nM. MedChem Express
      UNC1215 is a potent and selective chemical probe for the methyllysine (Kme) reading function of L3MBTL3 with Kd value of 120 nM.; IC50 Value: 120 nM (Kd) [1]; Target: L3MBTL3 ; In vitro: UNC1215 binds L3MBTL3 with a K(d) of 120 nM, competitively displacing mono- or dimethyllysine-containing peptides, and is greater than 50-fold more potent toward L3MBTL3 than other members of the MBT family while also demonstrating selectivity against more than 200 other reader domains examined. MedChem Express HY-15649
      UNC1215 is a potent and selective chemical probe for the methyllysine (Kme) reading function of L3MBTL3 with Kd value of 120 nM.;IC50 Value: 120 nM (Kd) [1];Target: L3MBTL3 ;In vitro: UNC1215 binds L3MBTL3 with a K(d) of 120 nM, competitively displacing mono- or dimethyllysine-containing peptides, and is greater than 50-fold more potent toward L3MBTL3 than other members of the MBT family while also demonstrating selectivity against more than 200 other reader domains examined. X-ray crystallography identified a unique 2:2 polyvalent mode of interaction between UNC1215 and L3MBTL3. In cells, UNC1215 is nontoxic and directly binds L3MBTL3 via the Kme-binding pocket of the MBT domains. UNC1215 increases the cellular mobility of GFP-L3MBTL3 fusion proteins, and point mutants that disrupt the Kme-binding function of GFP-L3MBTL3 phenocopy the effects of UNC1215 on localization [1]. MedChem Express HY-15649

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 712.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.1±3.0 kJ/mol
Flash Point: 384.5±32.9 °C
Index of Refraction: 1.640
Molar Refractivity: 155.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.37
ACD/LogD (pH 5.5): -0.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 59 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 58.7±3.0 dyne/cm
Molar Volume: 432.5±3.0 cm3

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