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MCULE-5158617125
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.
|
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 | 17 working days | Get Quote |
| 5 mg | 50 USD | 90 | 17 working days | Get Quote |
| 10 mg | 64 USD | 90 | 17 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5158617125.sdf |
| SMILES | MCULE-5158617125.smiles |
| Standard InChI | MCULE-5158617125.inchi |
| InChIKey | MCULE-5158617125.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852085450 | A2B Chem | Predominantly Building Block on demand | 97 | As is | by synthesis |
| P-869238346 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851742507 | AmBeed | On request | N/A | As is | by synthesis |
| P-494415119 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-890204321 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-579483889 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
| P-503124835 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-454419871 | Key Organics | Building Blocks | 97 | As is | 993 mg |
| P-596546724 | Key Organics | Screening Compounds and Fragments | 97 | As is | 993 mg |
| P-19781086 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-33293727 | TimTec | ActiMol 2 Week | 90 | As is | in stock |
| P-855321224 | Toronto Research | In stock | 90 | As is | in stock |
| P-2524128 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 43 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 238.280 |
| logP | 3.5967 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 37.3 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 73.2375 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 14 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
