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MCULE-1045168738-1
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 | 34 USD | 90 | 17 working days | Get Quote |
| 5 mg | 35 USD | N/A | 35 working days | Get Quote |
| 10 mg | 35 USD | N/A | 35 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1045168738-1.sdf |
| SMILES | MCULE-1045168738-1.smiles |
| Standard InChI | MCULE-1045168738-1.inchi |
| InChIKey | MCULE-1045168738-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-590410494 | AK Scientific | Building Blocks | 98 | As an isomer | in stock |
| P-872944178 | AmBeed | On request | N/A | As an isomer | by synthesis |
| P-864087307 | AstaTech | In Stock BBs | 97 | As an isomer | in stock |
| P-590865231 | BLD pharm | Non-stock building blocks | 97 | As an isomer | by synthesis |
| P-851277116 | Chemshuttle | On request catalog | 95 | As an isomer | by synthesis |
| P-868649057 | Combi-Blocks | Building Block in stock | 97 | As an isomer | in stock |
| P-861972776 | FluoroChem | General BB | N/A | As an isomer | in stock |
| P-563452151 | Key Organics | Building Blocks | 97 | As an isomer | 1000 mg |
| P-615651130 | LabNetwork | In stock | 95 | As an isomer | in stock |
| P-856010720 | LaboTest | Screening Collection | 90 | As an isomer | 500 mg |
| P-854711970 | MedChemExpress | Screening compounds In stock | 95 | As an isomer | in stock |
| P-888889029 | PharmaBlock | In stock | N/A | As an isomer | in stock |
| P-500397521 | Pi Chemicals | Virtual Compounds | 97 | As an isomer | by synthesis |
| P-424895039 | Princeton Biomolecular Research | Screening Compounds | 90 | As an isomer | in stock |
| P-888655743 | TargetMol | Screening Compounds | 95 | As an isomer | by synthesis |
| P-869160458 | TargetMol | Screening Compounds - stock amount | 95 | As an isomer | in stock |
| P-611397836 | Toronto Research | In stock | 90 | As an isomer | in stock |
| P-35077855 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As an isomer | 91 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 143.144 |
| logP | -0.7226 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 76.42 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 42.9252 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
