MCULE-9743249390-0
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
---|---|---|---|---|
1 mg | 31 USD | N/A | 9 working days | Get Quote |
5 mg | 31 USD | N/A | 9 working days | Get Quote |
10 mg | 31 USD | N/A | 9 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
-
1
MCULE-1881097860-0
- Component type: Main
-
1
MCULE-9976402631-1
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-9743249390-0.sdf |
SMILES | MCULE-9743249390-0.smiles |
Standard InChI | MCULE-9743249390-0.inchi |
InChIKey | MCULE-9743249390-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886668253 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-889970957 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-869349213 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893390190 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
P-851435899 | AmBeed | On request | N/A | As is | by synthesis |
P-864297800 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-611017090 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
P-854817036 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-611545101 | Toronto Research | In stock | 90 | As is | in stock |
P-893846581 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
P-867600659 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
P-875757600 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
P-894659781 | AK Scientific | Building Blocks | 95 | Main component | in stock |
P-893366376 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | Main component | by synthesis |
P-851755571 | AmBeed | On request | N/A | Main component | by synthesis |
P-864151038 | AstaTech | In Stock BBs | 90 | Main component | in stock |
P-591093442 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
P-893266907 | Biosynth | Synthesis | 95 | Main component | by synthesis |
P-861514541 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
P-862094547 | FluoroChem | General BB | 95 | Main component | in stock |
P-890214166 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | Main component | in stock |
P-590336590 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | Main component | 1000 mg |
P-563640330 | Key Organics | Building Blocks | 95 | Main component | 250 mg |
P-854781732 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
P-888861662 | PharmaBlock | In stock | N/A | Main component | in stock |
P-859992160 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
P-893640900 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
Property | Value |
---|---|
Components | 2 |
Mass | 242.152 |
logP | -0.0261 |
H-bond acceptors | 6 |
H-bond donors | 2 |
Rotatable bonds | 1 |
PSA | 100.7 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 47.6442 |
Atoms | 25 |
Rings | 1 |
Heavy atoms | 16 |
Hydrogen atoms | 9 |
Heteroatoms | 9 |
N/O atoms | 6 |
Inorganic atoms | 0 |
Halogen atoms | 3 |
Chiral centers | 1 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 1 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |