MCULE-9265398992
- 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 | 39 USD | 95 | 9 working days | Get Quote |
5 mg | 75 USD | 95 | 9 working days | Get Quote |
10 mg | 126 USD | 95 | 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.
Name | File |
---|---|
SDF | MCULE-9265398992.sdf |
SMILES | MCULE-9265398992.smiles |
Standard InChI | MCULE-9265398992.inchi |
InChIKey | MCULE-9265398992.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867693806 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875874276 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-874630903 | AK Scientific | Building Blocks | N/A | As is | in stock |
P-505401641 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893611828 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 14.3 g |
P-867715808 | AmBeed | In stock | N/A | As is | in stock |
P-888829829 | Angene | Building Blocks in stock | 98 | As is | 100 mg |
P-889584646 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-887188410 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-579481449 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
P-524166997 | Key Organics | Building Blocks | 95 | As is | 10 mg |
P-854719652 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
P-871071879 | MedKoo | In stock compounds | 95 | As is | in stock |
P-888172823 | Molnova | On demand | 98 | As is | by synthesis |
P-873281385 | Shanghai iChemical | In stock | N/A | As is | in stock |
P-869163642 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-892299818 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-888658979 | TargetMol | Screening Compounds - stock amount | 95 | As is | 154 mg |
P-868524423 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 280.220 |
logP | 3.89498 |
H-bond acceptors | 2 |
H-bond donors | 0 |
Rotatable bonds | 3 |
PSA | 36.68 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 63.206 |
Atoms | 28 |
Rings | 2 |
Heavy atoms | 20 |
Hydrogen atoms | 8 |
Heteroatoms | 6 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 4 |
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 |