P933-0100 Screening compound: [2-methyl-1-(thiophene-3-carbonyl)pyrrolidin-2-yl]methanol
Chemical Structure Depiction of ChemDiv screening compound P933-0100
[2-methyl-1-(thiophene-3-carbonyl)pyrrolidin-2-yl]methanol
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
P933-0100
Molecular Formula
C11H15NO2S (C11 H15 NO2 S)
Compound Name
[2-methyl-1-(thiophene-3-carbonyl)pyrrolidin-2-yl]methanol
IUPAC name
n/a
SMILES
CC(CO)(CCC1)N1C(c1cscc1)=O
InChI
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
225.31
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
1.539
Distribution Coefficient, logD
1.539
Water Solubility, LogSw
-1.88
Polar Surface Area
34.866
Acid Dissociation Constant (pKa)
16.08
Base Dissociation Constant (pKb)
-4.31
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
54.54
P933-0100 in Drug Discovery
Included in Screening Libraries
3D Mimetics PPI Library (1617 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Epigenetics Focused Set (26518 compounds)
Included in 1.7M Stock Database
- Mimetics
- 3D
- Cyclic compounds
- PPI modulators
References: we are preparing a list of scientific research reports with P933-0100 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)