MCULE-2342883607
- 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 | 33 USD | 90 | 19 working days | Get Quote |
5 mg | 40 USD | N/A | 9 working days | Get Quote |
10 mg | 40 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-2548498765
- Component type: Main
-
1
MCULE-6647815245
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-2342883607.sdf |
SMILES | MCULE-2342883607.smiles |
Standard InChI | MCULE-2342883607.inchi |
InChIKey | MCULE-2342883607.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-34559280 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
P-617720978 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 2.66 g |
P-617744248 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 2.66 g |
P-860612718 | A2B Chem | Predominantly Building Block on demand | 95 | Main component | by synthesis |
P-889925131 | AA Blocks | AA Blocks - synthesis | N/A | Main component | by synthesis |
P-851578790 | AmBeed | On request | N/A | Main component | by synthesis |
P-674397213 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
P-575332427 | EvoBlocks | In-stock Building Blocks | 95 | Main component | in stock |
P-588250816 | Manchester Organics | Compounds on demand | N/A | Main component | by synthesis |
P-852599153 | Matrix Scientific | All | N/A | Main component | in stock |
P-895277430 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
P-855219692 | Toronto Research | In stock | 90 | Main component | in stock |
P-867670251 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
P-875844416 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
P-894636927 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
P-851819456 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
P-611144826 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
P-861377263 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
P-575332508 | EvoBlocks | In-stock Building Blocks | 95 | Main component as a main component | in stock |
P-862059465 | FluoroChem | General BB | 95 | Main component as a main component | in stock |
P-855951876 | Key Organics | Building Blocks | 95 | Main component as a main component | 1000 mg |
P-854936513 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
P-893666054 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
Property | Value |
---|---|
Components | 2 |
Mass | 299.319 |
logP | 1.7483 |
H-bond acceptors | 7 |
H-bond donors | 3 |
Rotatable bonds | 6 |
PSA | 105.09 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 76.8863 |
Atoms | 42 |
Rings | 1 |
Heavy atoms | 21 |
Hydrogen atoms | 21 |
Heteroatoms | 7 |
N/O atoms | 7 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
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 |