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MCULE-2245459005
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 | 26 USD | 98 | 14 working days | Get Quote |
| 5 mg | 61 USD | 98 | 16 working days | Get Quote |
| 10 mg | 86 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2245459005.sdf |
| SMILES | MCULE-2245459005.smiles |
| Standard InChI | MCULE-2245459005.inchi |
| InChIKey | MCULE-2245459005.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903120811 | 98 | As is | 600 mg |
| P-1264051593 | 95 | As is | in stock |
| P-893493659 | 90 | As is | 9.691 g |
| P-580726774 | 98 | As is | 272 mg |
| P-1275107952 | N/A | As is | by resynthesis (? - ? days) |
| P-851280510 | 95 | As is | by synthesis |
| P-861368436 | 95 | As is | by synthesis |
| P-579481007 | 95 | As is | in stock |
| P-901411595 | 98 | As is | 600 mg |
| P-584625285 | 95 | As is | in stock |
| P-878642290 | 98 | As is | in stock |
| P-860340455 | 95 | As is | by synthesis |
| P-617404099 | 98 | As is | in stock |
| P-563428513 | 95 | As an isomer | 100 mg |
| P-885540918 | 95 | As an isomer | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 345.362 |
| logP | 1.8788 |
| H-bond acceptors | 9 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 91.61 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 94.907 |
| Atoms | 41 |
| Rings | 5 |
| Heavy atoms | 26 |
| Hydrogen atoms | 15 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
