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MCULE-1090101098
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 | 25 USD | N/A | 9 working days | Get Quote |
| 5 mg | 25 USD | N/A | 9 working days | Get Quote |
| 10 mg | 25 USD | N/A | 9 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-2295371442
- Component type: Main
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MCULE-3270155028
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1090101098.sdf |
| SMILES | MCULE-1090101098.smiles |
| Standard InChI | MCULE-1090101098.inchi |
| InChIKey | MCULE-1090101098.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-12493695 | 90 | As is | 300 mg |
| P-519832101 | 90 | As is | in stock |
| P-25599826 | 90 | As is | 124 mg |
| P-616223033 | N/A | As a main component | in stock |
| P-851954528 | N/A | As a main component | in stock |
| P-896035318 | 95 | As a main component | by synthesis |
| P-893225018 | 95 | As a main component | in stock |
| P-870663044 | N/A | As a main component | in stock |
| P-856045829 | 90 | As a main component | 5 g |
| P-856037114 | 90 | As a main component | 5 g |
| P-856035998 | 90 | As a main component | 250 mg |
| P-885559354 | 95 | As a main component | by synthesis |
| P-873215801 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 539.337 |
| logP | 5.375 |
| H-bond acceptors | 9 |
| H-bond donors | 4 |
| Rotatable bonds | 5 |
| PSA | 174.65 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 127.4059 |
| Atoms | 51 |
| Rings | 3 |
| Heavy atoms | 35 |
| Hydrogen atoms | 16 |
| Heteroatoms | 12 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
