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MCULE-4391474837-0
Structure
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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.
|
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 | 70 USD | 90 | 8 working days | Get Quote |
| 5 mg | 97 USD | N/A | 22 working days | Get Quote |
| 10 mg | 234 USD | 90 | 8 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4391474837-0.sdf |
| SMILES | MCULE-4391474837-0.smiles |
| Standard InChI | MCULE-4391474837-0.inchi |
| InChIKey | MCULE-4391474837-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893138838 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867441652 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867455248 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-489152313 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-870651913 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-870651914 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-855918344 | Key Organics | Building Blocks | 97 | As is | 50 mg |
| P-596584243 | Key Organics | Building Blocks | 95 | As is | 50 mg |
| P-885545395 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-33163037 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 142 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 862.736 |
| logP | -1.0956 |
| H-bond acceptors | 20 |
| H-bond donors | 12 |
| Rotatable bonds | 9 |
| PSA | 347.96 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 202.796 |
| Atoms | 100 |
| Rings | 8 |
| Heavy atoms | 62 |
| Hydrogen atoms | 38 |
| Heteroatoms | 20 |
| N/O atoms | 20 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 12 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 12 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
