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MCULE-6855050004
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 | 45 USD | 95 | 37 working days | Get Quote |
| 5 mg | 75 USD | 98 | 16 working days | Get Quote |
| 10 mg | 98 USD | 98 | 16 working days | Get Quote |
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MCULE-9551873833
- Component type: Main
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MCULE-6909120047
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6855050004.sdf |
| SMILES | MCULE-6855050004.smiles |
| Standard InChI | MCULE-6855050004.inchi |
| InChIKey | MCULE-6855050004.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-608082044 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-889865834 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-855916378 | Key Organics | Building Blocks | 97 | As a main component | 5 mg |
| P-888624126 | Key Organics | Building Blocks | 95 | As a main component | 1 mg |
| P-619673948 | Molnova | Stock | 98 | As a main component | in stock |
| P-888658306 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869162836 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 1084.237 |
| logP | 1.161 |
| H-bond acceptors | 27 |
| H-bond donors | 14 |
| Rotatable bonds | 22 |
| PSA | 514.53 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 295.6303 |
| Atoms | 140 |
| Rings | 4 |
| Heavy atoms | 75 |
| Hydrogen atoms | 65 |
| Heteroatoms | 29 |
| N/O atoms | 27 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 8 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 8 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
