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MCULE-9818968164
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 | 44 USD | 95 | 14 working days | Get Quote |
| 5 mg | 44 USD | 95 | 14 working days | Get Quote |
| 10 mg | 69 USD | 95 | 14 working days | Get Quote |
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MCULE-5513128467
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9818968164.sdf |
| SMILES | MCULE-9818968164.smiles |
| Standard InChI | MCULE-9818968164.inchi |
| InChIKey | MCULE-9818968164.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903225332 | 98 | As is | 2 g |
| P-893442790 | 90 | As is | 6.528 g |
| P-590709758 | 98 | As is | 1.556 g |
| P-896543179 | 95 | As is | in stock |
| P-862148209 | 98 | As is | 2 g |
| P-854720176 | 95 | As is | in stock |
| P-896628049 | 95 | As is | by synthesis |
| P-871075012 | 95 | As is | in stock |
| P-904333119 | 90 | As a main component | 65.227 g |
| P-873436263 | 99 | As a main component | 1 mg |
| P-505575317 | 98 | As a main component | in stock |
| P-851286687 | 95 | As a main component | by synthesis |
| P-861343290 | 95 | As a main component | by synthesis |
| P-896627365 | 95 | As a main component | by synthesis |
| P-1263957113 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 670.840 |
| logP | 4.9033 |
| H-bond acceptors | 11 |
| H-bond donors | 5 |
| Rotatable bonds | 16 |
| PSA | 166.75 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 192.8668 |
| Atoms | 99 |
| Rings | 5 |
| Heavy atoms | 49 |
| Hydrogen atoms | 50 |
| Heteroatoms | 11 |
| N/O atoms | 11 |
| 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 |
