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UNKNOWN STEREO
MCULE-5533307091-0
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 | 16 USD | 98 | 20 working days | Get Quote |
| 5 mg | 16 USD | 98 | 20 working days | Get Quote |
| 10 mg | 16 USD | 98 | 20 working days | Get Quote |
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MCULE-4048536115-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5533307091-0.sdf |
| SMILES | MCULE-5533307091-0.smiles |
| Standard InChI | MCULE-5533307091-0.inchi |
| InChIKey | MCULE-5533307091-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867537147 | 98 | As a main component | in stock |
| P-875692843 | 98 | As a main component | in stock |
| P-596936688 | 98 | As a main component | 890 mg |
| P-901428513 | 95 | As a main component | by synthesis |
| P-893236741 | 95 | As a main component | in stock |
| P-860799584 | 98 | As a main component | in stock |
| P-580452316 | 99 | As a main component | in stock |
| P-505516980 | 95 | As a main component | in stock |
| P-869107624 | 95 | As a main component | 938 mg |
| P-892286235 | 95 | As a main component | 684 mg |
| P-888626658 | 95 | As a main component | 684 mg |
| P-611360112 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 529.773 |
| logP | 4.3042 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 59.0 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 160.4708 |
| Atoms | 91 |
| Rings | 6 |
| Heavy atoms | 38 |
| Hydrogen atoms | 53 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 10 |
| R/S chiral centers | 10 |
| 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 |
