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MCULE-8176054049-0
Structure
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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 | 11 USD | 98 | 22 working days | Get Quote |
| 5 mg | 13 USD | 98 | 22 working days | Get Quote |
| 10 mg | 16 USD | 98 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-8176054049-0.sdf |
| SMILES | MCULE-8176054049-0.smiles |
| Standard InChI | MCULE-8176054049-0.inchi |
| InChIKey | MCULE-8176054049-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867619962 | 98 | As is | in stock |
| P-869273826 | 95 | As is | by resynthesis (? - ? days) |
| P-872725702 | 98 | As is | in stock |
| P-610974806 | 90 | As is | 36.976 g |
| P-606932071 | N/A | As is | in stock |
| P-596964266 | 98 | As is | 1.975 g |
| P-1273267024 | 95 | As is | by resynthesis (? - ? days) |
| P-864144566 | 95 | As is | in stock |
| P-901496772 | 95 | As is | by synthesis |
| P-851278874 | 95 | As is | by synthesis |
| P-860799154 | 98 | As is | in stock |
| P-870660097 | N/A | As is | in stock |
| P-868078632 | 95 | As is | in stock |
| P-596561764 | 97 | As is | 100 mg |
| P-35203529 | 90 | As is | in stock |
| P-579713017 | 98 | As is | in stock |
| P-892291947 | 95 | As is | unavailable |
| P-869131097 | 95 | As is | 189 mg |
| P-888642466 | 95 | As is | 189 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 311.331 |
| logP | 3.3431 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 56.79 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 91.6147 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 23 |
| Hydrogen atoms | 17 |
| 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 | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
