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MCULE-4497118445
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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 50 USD | 90 | 19 working days | Get Quote |
| 10 mg | 63 USD | 90 | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4497118445.sdf |
| SMILES | MCULE-4497118445.smiles |
| Standard InChI | MCULE-4497118445.inchi |
| InChIKey | MCULE-4497118445.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893135342 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-596321866 | Asinex | General screening catalog | 90 | As is | 4 mg |
| P-55464 | Chemical Block | Screening Library | 90 | As is | 5 mg |
| P-851307060 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-617819248 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-524164617 | Key Organics | Building Blocks | 98 | As is | 1000 mg |
| P-856005865 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-895336909 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-520022436 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885532775 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-2329724 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 120 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 408.256 |
| logP | 2.9103 |
| H-bond acceptors | 8 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 100.92 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 89.814 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 25 |
| Hydrogen atoms | 15 |
| Heteroatoms | 11 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
