Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3378746616
Compound
Show structure
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 | 33 USD | 95 | 10 working days | Get Quote |
| 5 mg | 33 USD | 95 | 10 working days | Get Quote |
| 10 mg | 33 USD | 95 | 10 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-3123237237
- Component type: Main
-
1
MCULE-1504889908
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3378746616.sdf |
| SMILES | MCULE-3378746616.smiles |
| Standard InChI | MCULE-3378746616.inchi |
| InChIKey | MCULE-3378746616.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867668823 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875842929 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-851421861 | AmBeed | On request | N/A | As is | by synthesis |
| P-489245413 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-611018816 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-666934239 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-666897566 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 10 mg |
| P-868570111 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-862057896 | FluoroChem | General BB | N/A | As is | in stock |
| P-855950152 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-864073081 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-868543080 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-851530214 | AmBeed | On request | N/A | Main component | by synthesis |
| P-590893155 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-861514298 | Combi-Blocks | Building Block on demand | 90 | Main component | by synthesis |
| P-580409845 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-881679516 | EDASA Scientific Limited | Synthesis Building Blocks | N/A | Main component | by resynthesis (? - ? days) |
| P-579487672 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | Main component | in stock |
| P-454360204 | Key Organics | Screening Compounds and Fragments | 90 | Main component | 100 mg |
| P-874467074 | Life Chemicals | Building Blocks - virtual | 95 | Main component | by synthesis |
| P-424893460 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-611471484 | Toronto Research | In stock | 90 | Main component | in stock |
| P-25490267 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 980 mg |
| P-867731450 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-862396402 | BLD pharm | Non-stock building blocks | 97 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 261.301 |
| logP | 2.2399 |
| H-bond acceptors | 7 |
| H-bond donors | 4 |
| Rotatable bonds | 3 |
| PSA | 136.09 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 64.4377 |
| Atoms | 32 |
| Rings | 1 |
| Heavy atoms | 17 |
| Hydrogen atoms | 15 |
| Heteroatoms | 8 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |
