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MCULE-4622019833
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 | 184 USD | 99 | 24 working days | Get Quote |
| 5 mg | 260 USD | 95 | 14 working days | Get Quote |
| 10 mg | 396 USD | 95 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4622019833.sdf |
| SMILES | MCULE-4622019833.smiles |
| Standard InChI | MCULE-4622019833.inchi |
| InChIKey | MCULE-4622019833.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893607907 | 90 | As is | 873 mg |
| P-901865398 | 99 | As is | by synthesis |
| P-887187956 | 95 | As is | by synthesis |
| P-900266936 | 95 | As is | in stock |
| P-1275598924 | 95 | As is | by synthesis |
| P-854716616 | 95 | As is | in stock |
| P-871076216 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 614.501 |
| logP | 5.5372 |
| H-bond acceptors | 8 |
| H-bond donors | 1 |
| Rotatable bonds | 11 |
| PSA | 86.17 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 155.0798 |
| Atoms | 73 |
| Rings | 4 |
| Heavy atoms | 40 |
| Hydrogen atoms | 33 |
| Heteroatoms | 10 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
