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MCULE-4580442571
Compound
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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.
|
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 | 87 USD | 97 | 17 working days | Get Quote |
| 5 mg | 87 USD | 97 | 17 working days | Get Quote |
| 10 mg | 87 USD | 97 | 17 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4580442571.sdf |
| SMILES | MCULE-4580442571.smiles |
| Standard InChI | MCULE-4580442571.inchi |
| InChIKey | MCULE-4580442571.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-500417497 | Glentham Life Sciences | Compounds maintained in stock | 97 | As is | in stock |
| P-524165924 | Key Organics | Building Blocks | 98 | As is | 5 mg |
| P-524163413 | Key Organics | Building Blocks | 98 | As is | 100 mg |
| P-885538466 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-23117726 | TimTec | ActiMol 2 Week | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 410.450 |
| logP | 1.8437 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 94.83 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 102.0074 |
| Atoms | 57 |
| Rings | 4 |
| Heavy atoms | 29 |
| Hydrogen atoms | 28 |
| Heteroatoms | 7 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 9 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 9 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
