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MCULE-9205628747-0
Structure
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- InChIKey:
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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.
|
|
|---|---|---|---|---|
| 1 mg | 31 USD | 98 | 16 working days | Get Quote |
| 5 mg | 50 USD | 98 | 16 working days | Get Quote |
| 10 mg | 79 USD | 98 | 16 working days | Get Quote |
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MCULE-1729530537-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9205628747-0.sdf |
| SMILES | MCULE-9205628747-0.smiles |
| Standard InChI | MCULE-9205628747-0.inchi |
| InChIKey | MCULE-9205628747-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596562301 | Key Organics | Building Blocks | 97 | As a main component | 100 mg |
| P-608121510 | LabSeeker, Inc | Stock Collection | 98 | As a main component | in stock |
| P-619674069 | Molnova | Stock | 98 | As a main component | in stock |
| P-885540359 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As a main component | by synthesis |
| P-888656640 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869161415 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 630.580 |
| logP | 4.5912 |
| H-bond acceptors | 8 |
| H-bond donors | 1 |
| Rotatable bonds | 13 |
| PSA | 105.39 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 154.9382 |
| Atoms | 74 |
| Rings | 4 |
| Heavy atoms | 45 |
| Hydrogen atoms | 29 |
| Heteroatoms | 13 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 5 |
| 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 |
