8010-6933 Screening compound: 3-(1H-indol-3-yl)-2-[(5-methylfuran-2-yl)formamido]propanoic acid
Chemical Structure Depiction of ChemDiv screening compound 8010-6933
3-(1H-indol-3-yl)-2-[(5-methylfuran-2-yl)formamido]propanoic acid
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
8010-6933
Molecular Formula
C17H16N2O4 (C17 H16 N2 O4)
Compound Name
3-(1H-indol-3-yl)-2-[(5-methylfuran-2-yl)formamido]propanoic acid
IUPAC name
3-(1H-indol-3-yl)-2-[(5-methylfuran-2-yl)formamido]propanoic acid
SMILES
Cc1ccc(C(NC(Cc2c[nH]c3c2cccc3)C(O)=O)=O)o1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
312.33
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
1.596
Distribution Coefficient, logD
-1.895
Water Solubility, LogSw
-1.98
Polar Surface Area
70.654
Acid Dissociation Constant (pKa)
3.91
Base Dissociation Constant (pKb)
-2.41
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
17.60
8010-6933 in Drug Discovery
Included in Screening Libraries
Arginase Targeted Library (2009 compounds)
RAR (Nuclear receptors) Ligands Library (6524 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
PD-1/L1 Library (498 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Male
- Cardiovascular
- Cancer
- Respiratory tract
- Eye
- Male
- Female
- Hemic and lymphatic
- Congenital
- Skin
- Endocrine
- Immune system
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Cancer
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Immune system
- Others
- Nuclear receptors
- Others
- Receptor's ligands
- Epigenetic
References: we are preparing a list of scientific research reports with 8010-6933 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)