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MCULE-5205487469
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 | 39 USD | 95 | 37 working days | Get Quote |
| 5 mg | 97 USD | 90 | 12 working days | Get Quote |
| 10 mg | 109 USD | N/A | 35 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-5205487469.sdf |
| SMILES | MCULE-5205487469.smiles |
| Standard InChI | MCULE-5205487469.inchi |
| InChIKey | MCULE-5205487469.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886630673 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-869283375 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851790986 | AmBeed | On request | N/A | As is | by synthesis |
| P-596391500 | Asinex | General screening catalog | 90 | As is | 2 mg |
| P-889846588 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-611133173 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-619296511 | ChemDiv | Discovery Chemistry Library | 90 | As is | 5 mg |
| P-889033602 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-889281943 | FluoroChem | General BB | N/A | As is | in stock |
| P-888643122 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869132464 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 212.314 |
| logP | 1.5705 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 64.43 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 69.1147 |
| Atoms | 30 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 16 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
