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UNKNOWN STEREO
MCULE-1788890083
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 | 45 USD | 90 | 23 working days | Get Quote |
| 5 mg | 64 USD | 95 | 20 working days | Get Quote |
| 10 mg | 87 USD | 90 | 23 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-4090205035
- Component type: Main
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MCULE-7839063278
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1788890083.sdf |
| SMILES | MCULE-1788890083.smiles |
| Standard InChI | MCULE-1788890083.inchi |
| InChIKey | MCULE-1788890083.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-885897473 | A2B Chem | Predominantly Building Block on demand | 98 | As is | by synthesis |
| P-851446322 | AmBeed | On request | N/A | As is | by synthesis |
| P-888635572 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869120828 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-867616622 | A2B Chem | Predominantly Building Block in stock | 98 | As a main component | in stock |
| P-869311691 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-851927151 | AmBeed | In stock | N/A | As a main component | in stock |
| P-865915910 | Angene | Building Blocks in stock | 95 | As a main component | 672 mg |
| P-675328357 | Innovapharm | Virtual Building Blocks | 95 | As a main component | by synthesis |
| P-580036564 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
| P-870579791 | Innovapharm | Building Blocks | 95 | As a main component | in stock |
| P-24236889 | InterBioScreen | Screening Compounds | 92 | As a main component | 199 mg |
| P-674817212 | Otava | In-House Stock Library | 90 | As a main component | 1.5 g |
| P-26472407 | Otava | In-House Stock Library | 90 | As a main component | 0 mg |
| P-620218852 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As a main component | 1.5 g |
| P-888635571 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869120827 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| P-855066763 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-868515041 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 358.396 |
| logP | 3.2224 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 6 |
| PSA | 109.05 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 104.6628 |
| Atoms | 45 |
| Rings | 4 |
| Heavy atoms | 27 |
| Hydrogen atoms | 18 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
