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UNKNOWN STEREO
MCULE-3684036705-0
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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 USD | 98 | 20 working days | Get Quote |
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MCULE-9345194783-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3684036705-0.sdf |
| SMILES | MCULE-3684036705-0.smiles |
| Standard InChI | MCULE-3684036705-0.inchi |
| InChIKey | MCULE-3684036705-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867671681 | 70 | As is | in stock |
| P-875845229 | N/A | As is | in stock |
| P-869192222 | 95 | As is | in stock |
| P-874625359 | 98 | As is | in stock |
| P-505403959 | 99 | As is | in stock |
| P-505390992 | 98 | As is | in stock |
| P-606937965 | N/A | As is | in stock |
| P-875891391 | 98 | As is | 1000 g |
| P-889496711 | 95 | As is | by synthesis |
| P-864150867 | 95 | As is | in stock |
| P-901465052 | 95 | As is | by synthesis |
| P-893237898 | 95 | As is | in stock |
| P-890851934 | 90 | As is | in stock |
| P-872091203 | 90 | As is | 6.946 g |
| P-13401544 | 92 | As is | 300 mg |
| P-892224453 | 95 | As is | by synthesis |
| P-869175837 | 95 | As is | in stock |
| P-892289480 | 95 | As is | 1.001 g |
| P-892318387 | 95 | As is | 1.001 g |
| P-611425735 | 90 | As is | in stock |
| P-886964142 | 95 | As is | by synthesis |
| P-867621397 | 99 | As a main component | in stock |
| P-875784055 | N/A | As a main component | in stock |
| P-865917514 | 99 | As a main component | 300 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 430.705 |
| logP | 8.8402 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 12 |
| PSA | 29.46 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 139.271 |
| Atoms | 81 |
| Rings | 2 |
| Heavy atoms | 31 |
| Hydrogen atoms | 50 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
