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MCULE-6486212844
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 | 22 USD | 99 | 15 working days | Get Quote |
| 5 mg | 40 USD | 98 | 16 working days | Get Quote |
| 10 mg | 56 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6486212844.sdf |
| SMILES | MCULE-6486212844.smiles |
| Standard InChI | MCULE-6486212844.inchi |
| InChIKey | MCULE-6486212844.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903017140 | 99 | As is | 2 g |
| P-610959785 | 90 | As is | 41.504 g |
| P-900155426 | 98 | As is | in stock |
| P-580715546 | 99 | As is | 1.371 g |
| P-871218981 | N/A | As is | by resynthesis (? - ? days) |
| P-881633943 | 98 | As is | in stock |
| P-851243183 | 95 | As is | by synthesis |
| P-861481200 | 95 | As is | by synthesis |
| P-579478656 | 95 | As is | in stock |
| P-852521146 | N/A | As is | in stock |
| P-1263153529 | 95 | As is | by synthesis |
| P-854714750 | 95 | As is | in stock |
| P-474023082 | 95 | As is | in stock |
| P-608270400 | 98 | As is | in stock |
| P-579712132 | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 416.861 |
| logP | 4.5565 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 88.49 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 118.3964 |
| Atoms | 47 |
| Rings | 5 |
| Heavy atoms | 30 |
| Hydrogen atoms | 17 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
