Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6479612494-0
Structure
Show compound
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 17 USD | 97 | 14 working days | Get Quote |
| 5 mg | 17 USD | 97 | 14 working days | Get Quote |
| 10 mg | 17 USD | 97 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-1208941194-0
- Component type: Main
-
1
MCULE-1568229930-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6479612494-0.sdf |
| SMILES | MCULE-6479612494-0.smiles |
| Standard InChI | MCULE-6479612494-0.inchi |
| InChIKey | MCULE-6479612494-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-903025076 | Aaron Chemicals LLC | Predominantly Building Block | 95 | As is | 500 g |
| P-893535877 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 1.525 kg |
| P-489231680 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-590793765 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-851307198 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868649309 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-854768147 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-903209447 | Aaron Chemicals LLC | Predominantly Building Block | 95 | Main component | 20 g |
| P-893510561 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 69.63 g |
| P-589656168 | Apollo Scientific | On request | 95 | Main component | by resynthesis (? - ? days) |
| P-605419489 | BLD pharm | In-stock building blocks | 95 | Main component | 1.735 g |
| P-851282156 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-861509737 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-862052982 | FluoroChem | General BB | N/A | Main component | in stock |
| P-863673737 | MedChemExpress | Building Blocks in stock | 95 | Main component | in stock |
| P-888854854 | PharmaBlock | In stock | N/A | Main component | in stock |
| P-903022742 | Aaron Chemicals LLC | Predominantly Building Block | 97 | Main component as a main component | 400 g |
| P-893518754 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component as a main component | 1.07384 kg |
| P-489211990 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component as a main component | in stock |
| P-590619162 | BLD pharm | In-stock building blocks | 97 | Main component as a main component | 5.95 g |
| P-851251961 | Chemshuttle | On request catalog | 95 | Main component as a main component | by synthesis |
| P-868646051 | Combi-Blocks | Building Block in stock | 97 | Main component as a main component | in stock |
| P-862072015 | FluoroChem | General BB | N/A | Main component as a main component | in stock |
| P-579628871 | LabSeeker, Inc | Stock Collection | 97 | Main component as a main component | in stock |
| P-852524237 | Matrix Scientific | All | N/A | Main component as a main component | in stock |
| P-901004870 | MedChemExpress | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 315.294 |
| logP | 0.4564 |
| H-bond acceptors | 7 |
| H-bond donors | 5 |
| Rotatable bonds | 4 |
| PSA | 127.09 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 77.5989 |
| Atoms | 40 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 18 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
