MCULE-3216119187
- 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 | 29 USD | N/A | 14 working days | Get Quote |
5 mg | 29 USD | N/A | 14 working days | Get Quote |
10 mg | 29 USD | N/A | 14 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-3216119187.sdf |
SMILES | MCULE-3216119187.smiles |
Standard InChI | MCULE-3216119187.inchi |
InChIKey | MCULE-3216119187.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867572761 | A2B Chem | Predominantly Building Block in stock | 90 | As is | in stock |
P-875733915 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-590367781 | AK Scientific | Building Blocks | 90 | As is | in stock |
P-893599337 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 271.802 g |
P-425022472 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-436473484 | Alinda | Building Blocks | 95 | As is | in stock |
P-606834494 | AmBeed | In stock | N/A | As is | in stock |
P-489166391 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-619182433 | Angene | Building Blocks in stock | 98 | As is | 15 g |
P-895924382 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864161545 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-590751421 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
P-454733622 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-861344340 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-580302078 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-862070066 | FluoroChem | General BB | 98 | As is | in stock |
P-596563134 | Key Organics | Building Blocks | 97 | As is | 250 mg |
P-31249318 | LaboTest | Screening Collection | 90 | As is | unavailable |
P-874466028 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
P-611666673 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-852533388 | Matrix Scientific | All | N/A | As is | in stock |
P-872794740 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
P-500383620 | Pi Chemicals | Virtual Compounds | N/A | As is | by synthesis |
P-502373846 | TimTec | Building Block Collection | 90 | As is | in stock |
P-888578326 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-611386807 | Toronto Research | In stock | 90 | As is | in stock |
P-615420565 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 193.243 |
logP | 4.1564 |
H-bond acceptors | 1 |
H-bond donors | 1 |
Rotatable bonds | 0 |
PSA | 26.02 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 65.8584 |
Atoms | 26 |
Rings | 3 |
Heavy atoms | 15 |
Hydrogen atoms | 11 |
Heteroatoms | 1 |
N/O atoms | 1 |
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 |