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MCULE-5101048876-2
Structure
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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 | 35 USD | 95 | 14 working days | Get Quote |
| 5 mg | 35 USD | 95 | 14 working days | Get Quote |
| 10 mg | 41 USD | 95 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5101048876-2.sdf |
| SMILES | MCULE-5101048876-2.smiles |
| Standard InChI | MCULE-5101048876-2.inchi |
| InChIKey | MCULE-5101048876-2.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-34860803 | Alinda | Stock Screening Compounds | 90 | As an isomer | in stock |
| P-436472483 | Alinda | Building Blocks | 95 | As an isomer | 1000 mg |
| P-454730277 | ChemDiv | Building Blocks in stock | 90 | As an isomer | in stock |
| P-241717 | Chemical Block | Screening Library | 90 | As an isomer | 2 mg |
| P-868632500 | Combi-Blocks | Building Block in stock | 95 | As an isomer | in stock |
| P-862069364 | FluoroChem | General BB | N/A | As an isomer | in stock |
| P-852532486 | Matrix Scientific | All | N/A | As an isomer | in stock |
| P-19630931 | Princeton Biomolecular Research | Screening Compounds | 90 | As an isomer | in stock |
| P-869139556 | TargetMol | Screening Compounds - synthesis | 95 | As an isomer | by synthesis |
| P-888646088 | TargetMol | Screening Compounds - stock amount | 95 | As an isomer | unavailable |
| P-22948833 | TimTec | ActiMol 3 Week | 90 | As an isomer | in stock |
| P-888445029 | TimTec | ActiMol 4 Week - On demand | 94 | As an isomer | by resynthesis (? - ? days) |
| P-1851450 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As an isomer | 6 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 211.650 |
| logP | 2.5334 |
| H-bond acceptors | 5 |
| H-bond donors | 4 |
| Rotatable bonds | 3 |
| PSA | 100.28 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 58.2552 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 10 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
