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UNKNOWN STEREO
MCULE-2586080519
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 | 20 USD | 98 | 20 working days | Get Quote |
| 5 mg | 20 USD | 98 | 20 working days | Get Quote |
| 10 mg | 20 USD | 98 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2586080519.sdf |
| SMILES | MCULE-2586080519.smiles |
| Standard InChI | MCULE-2586080519.inchi |
| InChIKey | MCULE-2586080519.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867585762 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875744249 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590414499 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851512879 | AmBeed | On request | N/A | As is | by synthesis |
| P-596988825 | Angene | Building Blocks in stock | 98 | As is | 1000 mg |
| P-864196602 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580272501 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-492241875 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-611400929 | Toronto Research | In stock | 90 | As is | in stock |
| P-25504157 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 82 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 193.626 |
| logP | 0.8415 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 66.4 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 45.3325 |
| Atoms | 24 |
| Rings | 0 |
| Heavy atoms | 12 |
| Hydrogen atoms | 12 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
