MCULE-8881683750
- 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 | 73 USD | 95 | 25 working days | Get Quote |
5 mg | 73 USD | 95 | 25 working days | Get Quote |
10 mg | 73 USD | 95 | 25 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.
-
MCULE-4835430740
- Component type: Main
Name | File |
---|---|
SDF | MCULE-8881683750.sdf |
SMILES | MCULE-8881683750.smiles |
Standard InChI | MCULE-8881683750.inchi |
InChIKey | MCULE-8881683750.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886637912 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-889937317 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-869210080 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-610898234 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
P-851529326 | AmBeed | On request | N/A | As is | by synthesis |
P-864265339 | AstaTech | Backordered BBs | 97 | As is | by synthesis |
P-590977846 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-861473010 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-575332396 | EvoBlocks | In-stock Building Blocks | 95 | As is | in stock |
P-861997818 | FluoroChem | General BB | N/A | As is | in stock |
P-580494034 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-895277318 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-611573545 | Toronto Research | In stock | 90 | As is | in stock |
P-893777888 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
P-674992032 | A2B Chem | Predominantly Building Block on demand | 95 | As a main component | by synthesis |
P-889955448 | AA Blocks | AA Blocks - synthesis | N/A | As a main component | by synthesis |
P-575332473 | EvoBlocks | In-stock Building Blocks | 95 | As a main component | in stock |
P-611664958 | Manchester Organics | Compounds on demand | N/A | As a main component | by synthesis |
P-895277525 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
P-873226332 | TimTec | Building Block Collection | 90 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 167.223 |
logP | 2.7146 |
H-bond acceptors | 1 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 12.03 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 48.5887 |
Atoms | 26 |
Rings | 1 |
Heavy atoms | 12 |
Hydrogen atoms | 14 |
Heteroatoms | 2 |
N/O atoms | 1 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
Chiral centers | 0 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |