Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9329247097-0
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 | 134 USD | 95 | 22 working days | Get Quote |
| 5 mg | 134 USD | 95 | 22 working days | Get Quote |
| 10 mg | 134 USD | 95 | 22 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-4302129900-0
- Component type: Main
-
1
MCULE-6572487779-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9329247097-0.sdf |
| SMILES | MCULE-9329247097-0.smiles |
| Standard InChI | MCULE-9329247097-0.inchi |
| InChIKey | MCULE-9329247097-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-885961834 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-893471132 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 60.873 g |
| P-851802128 | AmBeed | On request | N/A | As is | by synthesis |
| P-889828852 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-608394371 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-868549976 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-862112088 | FluoroChem | General BB | 95 | As is | in stock |
| P-601071253 | Life Chemicals | Screening Compounds | 90 | As is | in stock |
| P-25840574 | Life Chemicals | Building Blocks | 95 | As is | in stock |
| P-852508632 | Matrix Scientific | All | N/A | As is | in stock |
| P-895261511 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-855252476 | Toronto Research | In stock | 90 | As is | in stock |
| P-875809696 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-889828963 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-888162532 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-861397995 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-502530087 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-579636963 | LabSeeker, Inc | On demand Catalog | 97 | Main component | by resynthesis (? - ? days) |
| P-613315229 | Life Chemicals | Building Blocks - virtual | 95 | Main component | by synthesis |
| P-854911417 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-892877929 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-890024034 | AA Blocks | AA Blocks - synthesis | N/A | Main component as a main component | by synthesis |
| P-893763555 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 291.327 |
| logP | 2.467 |
| H-bond acceptors | 8 |
| H-bond donors | 4 |
| Rotatable bonds | 4 |
| PSA | 143.11 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 72.4866 |
| Atoms | 36 |
| Rings | 1 |
| Heavy atoms | 19 |
| Hydrogen atoms | 17 |
| Heteroatoms | 9 |
| N/O atoms | 8 |
| 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 | 1 |
| Undefined stereo double bonds | 0 |
