Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9550944601
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 | 44 USD | 95 | 20 working days | Get Quote |
| 10 mg | 44 USD | 95 | 20 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.
| Name | File |
|---|---|
| SDF | MCULE-9550944601.sdf |
| SMILES | MCULE-9550944601.smiles |
| Standard InChI | MCULE-9550944601.inchi |
| InChIKey | MCULE-9550944601.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867550831 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875708332 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869357709 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893510145 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 48.103 g |
| P-888184849 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606873203 | AmBeed | In stock | N/A | As is | in stock |
| P-596926868 | Angene | Building Blocks in stock | 95 | As is | 250 mg |
| P-895943330 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864139015 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580718797 | BLD pharm | In-stock building blocks | 95 | As is | 450 mg |
| P-4124515 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 25 mg |
| P-874588641 | ChemDiv | Discovery Chemistry Library | 90 | As is | unavailable |
| P-861518008 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-901385755 | FluoroChem | In Stock BB | N/A | As is | 1000 mg |
| P-524199198 | Key Organics | Building Blocks | 95 | As is | 250 mg |
| P-855396680 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-888864176 | PharmaBlock | In stock | N/A | As is | in stock |
| P-34212803 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491205197 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-611587472 | Toronto Research | In stock | 90 | As is | in stock |
| P-25553770 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 749 mg |
| P-575302455 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 190.238 |
| logP | 2.5226 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 26.3 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 55.7535 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 14 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
