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MCULE-1085681175
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.
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|
|---|---|---|---|---|
| 1 mg | 44 USD | N/A | 23 working days | Get Quote |
| 5 mg | 44 USD | N/A | 23 working days | Get Quote |
| 10 mg | 44 USD | N/A | 23 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-1085681175.sdf |
| SMILES | MCULE-1085681175.smiles |
| Standard InChI | MCULE-1085681175.inchi |
| InChIKey | MCULE-1085681175.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-489199631 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-866725140 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-861449705 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-861976991 | FluoroChem | General BB | N/A | As is | in stock |
| P-852467014 | Matrix Scientific | All | N/A | As is | in stock |
| P-868744662 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-888852532 | PharmaBlock | In stock | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 308.282 |
| logP | -0.0808 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 109.36 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 75.6264 |
| Atoms | 38 |
| Rings | 3 |
| Heavy atoms | 22 |
| Hydrogen atoms | 16 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
