MCULE-9907497241
- 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 | 98 | 15 working days | Get Quote |
5 mg | 33 USD | 98 | 15 working days | Get Quote |
10 mg | 33 USD | 98 | 15 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-9907497241.sdf |
SMILES | MCULE-9907497241.smiles |
Standard InChI | MCULE-9907497241.inchi |
InChIKey | MCULE-9907497241.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867628127 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875791642 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-590384930 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-610957163 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 266.993 g |
P-875895355 | Allbio Pharm | In stock | N/A | As is | in stock |
P-892509354 | AmBeed | In stock | N/A | As is | in stock |
P-489240189 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-596979853 | Angene | Building Blocks in stock | 98 | As is | 95.88 g |
P-579786308 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864115894 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-893279339 | BLD pharm | In-stock building blocks | 98 | As is | 22.219 g |
P-851249706 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-868583433 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-580377607 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
P-862016069 | FluoroChem | General BB | 95 | As is | in stock |
P-454376565 | Key Organics | Building Blocks | 95 | As is | 235.954 g |
P-18788993 | Key Organics | Screening Compounds and Fragments | 95 | As is | 233.953 g |
P-873388914 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-852412016 | Matrix Scientific | All | N/A | As is | in stock |
P-854724237 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
P-888871059 | PharmaBlock | In stock | N/A | As is | in stock |
P-885559641 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-613814815 | Spirochem | All | 95 | As is | in stock |
P-498729622 | Synthonix | In-stock Building Blocks | 97 | As is | 15 g |
P-502408663 | TimTec | Building Block Collection | 90 | As is | in stock |
P-855223906 | Toronto Research | In stock | 90 | As is | in stock |
P-480960851 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 255.310 |
logP | 2.031 |
H-bond acceptors | 5 |
H-bond donors | 0 |
Rotatable bonds | 3 |
PSA | 55.84 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 70.223 |
Atoms | 39 |
Rings | 2 |
Heavy atoms | 18 |
Hydrogen atoms | 21 |
Heteroatoms | 5 |
N/O atoms | 5 |
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 |