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MCULE-3963000692-1
Structure
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- InChI:
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| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
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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.
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|
|---|---|---|---|---|
| 1 mg | 34 USD | 90 | 17 working days | Get Quote |
| 5 mg | 50 USD | 90 | 17 working days | Get Quote |
| 10 mg | 64 USD | 90 | 17 working days | Get Quote |
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MCULE-6185531956-0
- Component type: Main
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MCULE-2876884115-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3963000692-1.sdf |
| SMILES | MCULE-3963000692-1.smiles |
| Standard InChI | MCULE-3963000692-1.inchi |
| InChIKey | MCULE-3963000692-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-500417966 | Glentham Life Sciences | Compounds maintained in stock | 38 | As a main component | in stock |
| P-890852160 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
| P-890851223 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
| P-890852452 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
| P-890851180 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
| P-890850034 | Innovapharm | Building Blocks | 95 | As a main component | in stock |
| P-596585515 | Key Organics | Building Blocks | 97 | As a main component | 500 mg |
| P-855928317 | Key Organics | Building Blocks | 95 | As a main component | 5 mg |
| P-881189903 | Otava | In-House Stock Library | 90 | As a main component | 50 mg |
| P-881187930 | Otava | In-House Stock Library | 90 | As a main component | 3 g |
| P-881190644 | Otava | In-House Stock Library | 90 | As a main component | 50 mg |
| P-881187967 | Otava | In-House Stock Library | 90 | As a main component | 125 mg |
| P-675096740 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
| P-885544188 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As a main component | by synthesis |
| P-617741878 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 1.928 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 198.152 |
| logP | -2.4924 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 89.9 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 44.9553 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 8 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
