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MCULE-4726185344
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 | 28 USD | 92 | 18 working days | Get Quote |
| 5 mg | 43 USD | 92 | 18 working days | Get Quote |
| 10 mg | 54 USD | 92 | 18 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4726185344.sdf |
| SMILES | MCULE-4726185344.smiles |
| Standard InChI | MCULE-4726185344.inchi |
| InChIKey | MCULE-4726185344.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-851434372 | N/A | As is | by synthesis |
| P-596490903 | 90 | As is | 1000 mg |
| P-596390388 | 90 | As is | 1000 mg |
| P-590754384 | 97 | As is | by synthesis |
| P-504780746 | 90 | As is | 1 mg |
| P-13939793 | 92 | As is | 269 mg |
| P-1272564590 | N/A | As is | 500 mg |
| P-852382366 | N/A | As is | by synthesis |
| P-13503534 | 92 | As is | 269 mg |
| P-873236820 | 90 | As is | in stock |
| P-903638448 | 94 | As is | by resynthesis (? - ? days) |
| P-22550530 | 90 | As is | 3 mg |
| P-578098020 | 90 | As is | 58 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 226.186 |
| logP | -0.6466 |
| H-bond acceptors | 7 |
| H-bond donors | 4 |
| Rotatable bonds | 5 |
| PSA | 119.75 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 51.8038 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
