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MCULE-3122779037-0
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.
|
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 | 34 USD | 90 | 19 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3122779037-0.sdf |
| SMILES | MCULE-3122779037-0.smiles |
| Standard InChI | MCULE-3122779037-0.inchi |
| InChIKey | MCULE-3122779037-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596363210 | Asinex | General screening catalog | 90 | As is | 43 mg |
| P-5205185 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 40 mg |
| P-12310530 | Otava | In-House Stock Library | 90 | As is | 520 mg |
| P-617683221 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 520 mg |
| P-454018731 | Specs | Screening Compounds | 90 | As is | 16 mg |
| P-873066187 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-873074165 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-24175863 | InterBioScreen | Screening Compounds | 92 | As a main component | unavailable |
| P-617684428 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As a main component | 416 mg |
| P-26361549 | Otava | In-House Stock Library | 90 | As a main component | 416 mg |
| P-617684429 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As a main component | 886 mg |
| P-617684431 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As a main component | 410 mg |
| P-26361552 | Otava | In-House Stock Library | 90 | As a main component | 886 mg |
| P-617684432 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As a main component | 815 mg |
| P-617684434 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As a main component | 600 mg |
| P-617684433 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As a main component | 994 mg |
| P-26361562 | Otava | In-House Stock Library | 90 | As a main component | 815 mg |
| P-26361565 | Otava | In-House Stock Library | 90 | As a main component | 994 mg |
| P-26361569 | Otava | In-House Stock Library | 90 | As a main component | 600 mg |
| P-617658407 | Otava | In-House Stock Library | 90 | As a main component | 410 mg |
| P-617791880 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 50 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 409.355 |
| logP | 4.3799 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 72.14 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 99.993 |
| Atoms | 47 |
| Rings | 3 |
| Heavy atoms | 29 |
| Hydrogen atoms | 18 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
