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MCULE-1500047676
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 | 156 USD | 95 | 24 working days | Get Quote |
| 5 mg | 156 USD | 95 | 24 working days | Get Quote |
| 10 mg | 156 USD | 95 | 24 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1500047676.sdf |
| SMILES | MCULE-1500047676.smiles |
| Standard InChI | MCULE-1500047676.inchi |
| InChIKey | MCULE-1500047676.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886614155 | 95 | As is | in stock |
| P-890158317 | N/A | As is | in stock |
| P-612936036 | 95 | As is | by resynthesis (? - ? days) |
| P-903153345 | 95 | As is | 5 g |
| P-851524025 | N/A | As is | by synthesis |
| P-595589315 | 90 | As is | 696 mg |
| P-596482468 | 90 | As is | 696 mg |
| P-590787879 | 95 | As is | by synthesis |
| P-896632132 | 95 | As is | by synthesis |
| P-580300219 | 95 | As is | by resynthesis (? - ? days) |
| P-1272563890 | N/A | As is | 2 g |
| P-852380822 | N/A | As is | by synthesis |
| P-895468313 | 95 | As is | by synthesis |
| P-500388979 | 98 | As is | by synthesis |
| P-33577401 | 94 | As is | by resynthesis (? - ? days) |
| P-855212579 | 90 | As is | in stock |
| P-588802417 | N/A | As is | by synthesis |
| P-893860710 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 232.188 |
| logP | 2.1629 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 87.74 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.5138 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
