Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7816052494
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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 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-1469892328
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7816052494.sdf |
| SMILES | MCULE-7816052494.smiles |
| Standard InChI | MCULE-7816052494.inchi |
| InChIKey | MCULE-7816052494.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-874628847 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-851724157 | AmBeed | On request | N/A | As is | by synthesis |
| P-889810943 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-611070329 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-861391468 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-19687222 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-25585144 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 100 mg |
| P-852113389 | A2B Chem | Predominantly Building Block on demand | 95 | Main component | by synthesis |
| P-889938050 | AA Blocks | AA Blocks - synthesis | N/A | Main component | by synthesis |
| P-894680381 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-436479124 | Alinda | Building Blocks | 95 | Main component | in stock |
| P-851458747 | AmBeed | On request | N/A | Main component | by synthesis |
| P-596496680 | Asinex | General bb catalog | 90 | Main component | 1000 mg |
| P-596448726 | Asinex | General screening catalog | 90 | Main component | 1000 mg |
| P-590780652 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-3841260 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component | 20 mg |
| P-454740166 | ChemDiv | Building Blocks in stock | 90 | Main component | in stock |
| P-874588161 | ChemDiv | Discovery Chemistry Library | 90 | Main component | unavailable |
| P-861524477 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-488551398 | InterBioScreen | Building Blocks | 90 | Main component | in stock |
| P-13754579 | InterBioScreen | Screening Compounds | 92 | Main component | 300 mg |
| P-596587354 | Key Organics | Building Blocks | 90 | Main component | 500 mg |
| P-856002402 | Key Organics | Screening Compounds and Fragments | 90 | Main component | 100 mg |
| P-852386718 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854903665 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-454372349 | Pharmeks LLC | Building Blocks | 92 | Main component | in stock |
| P-23858402 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-502390395 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-25005179 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 332 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 276.155 |
| logP | 3.1289 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 40.54 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 73.8868 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 15 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
