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MCULE-3547021803
Compound
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- 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 | 52 USD | 95 | 14 working days | Get Quote |
| 5 mg | 52 USD | 95 | 14 working days | Get Quote |
| 10 mg | 94 USD | 95 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3547021803.sdf |
| SMILES | MCULE-3547021803.smiles |
| Standard InChI | MCULE-3547021803.inchi |
| InChIKey | MCULE-3547021803.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-890240564 | BLD pharm | In-stock building blocks | 98 | As is | 5 g |
| P-887323779 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-872798370 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-852086512 | A2B Chem | Predominantly Building Block on demand | 97 | As an isomer | by synthesis |
| P-890151530 | AA Blocks | AA Blocks - in stock | N/A | As an isomer | in stock |
| P-869247423 | AK Scientific | Building Blocks | 95 | As an isomer | in stock |
| P-875889890 | Angene | Building Blocks in stock | 97 | As an isomer | 100 mg |
| P-889849792 | AstaTech | Backordered BBs | 95 | As an isomer | by synthesis |
| P-596575106 | Key Organics | Building Blocks | 95 | As an isomer | 10 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 227.300 |
| logP | 2.1695 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 55.4 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 61.9707 |
| Atoms | 37 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 21 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
