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UNKNOWN STEREO
MCULE-8611691549
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.
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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.
|
|
|---|---|---|---|---|
| 1 mg | 9 USD | 99 | 20 working days | Get Quote |
| 5 mg | 9 USD | 99 | 20 working days | Get Quote |
| 10 mg | 9 USD | 99 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-3345050161
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8611691549.sdf |
| SMILES | MCULE-8611691549.smiles |
| Standard InChI | MCULE-8611691549.inchi |
| InChIKey | MCULE-8611691549.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867568504 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875728835 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-869194040 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505351199 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505389271 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-596948577 | Angene | Building Blocks in stock | 97 | As is | 700 g |
| P-580195043 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864188181 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580405395 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-505493593 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-505491576 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-881187902 | Otava | In-House Stock Library | 90 | As is | 500 mg |
| P-500399871 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-869175469 | TargetMol | Natural Products | 95 | As is | 3.111 g |
| P-855296908 | Toronto Research | In stock | 90 | As is | in stock |
| P-875829942 | AA Blocks | AA Blocks | N/A | As a main component | in stock |
| P-590368046 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-596972594 | Angene | Building Blocks in stock | 99 | As a main component | 565 mg |
| P-881654623 | Apexbio Technology | Bioactive Compound Library | 98 | As a main component | in stock |
| P-864130674 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-505491317 | Hangzhou Apichem | Building Blocks in stock | 95 | As a main component | in stock |
| P-881190662 | Otava | In-House Stock Library | 90 | As a main component | 50 mg |
| P-888640367 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869127201 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| P-611364185 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-666976108 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 776.869 |
| logP | 5.2576 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 5 |
| PSA | 92.78 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 124.9082 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 24 |
| Hydrogen atoms | 11 |
| Heteroatoms | 9 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| 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 |
