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UNKNOWN STEREO
MCULE-6067917481
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 | 52 USD | 10 | 20 working days | Get Quote |
| 5 mg | 73 USD | 95 | 22 working days | Get Quote |
| 10 mg | 129 USD | N/A | 9 working days | Get Quote |
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MCULE-5005882190
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6067917481.sdf |
| SMILES | MCULE-6067917481.smiles |
| Standard InChI | MCULE-6067917481.inchi |
| InChIKey | MCULE-6067917481.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867621726 | N/A | As is | in stock |
| P-875783946 | N/A | As is | in stock |
| P-869339239 | 95 | As is | in stock |
| P-606881685 | N/A | As is | in stock |
| P-895098647 | 10 | As is | 50 mg |
| P-889521056 | 95 | As is | by synthesis |
| P-893259873 | 95 | As is | by synthesis |
| P-855066916 | 90 | As is | in stock |
| P-867697591 | 95 | As a main component | in stock |
| P-875877629 | N/A | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 614.778 |
| logP | 1.7793 |
| H-bond acceptors | 15 |
| H-bond donors | 9 |
| Rotatable bonds | 26 |
| PSA | 260.86 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 161.2025 |
| Atoms | 97 |
| Rings | 0 |
| Heavy atoms | 43 |
| Hydrogen atoms | 54 |
| Heteroatoms | 15 |
| N/O atoms | 15 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 6 |
| R/S chiral centers | 6 |
| 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 |
