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MCULE-4676972687
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 | 98 | 16 working days | Get Quote |
| 5 mg | 45 USD | 98 | 16 working days | Get Quote |
| 10 mg | 81 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4676972687.sdf |
| SMILES | MCULE-4676972687.smiles |
| Standard InChI | MCULE-4676972687.inchi |
| InChIKey | MCULE-4676972687.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-595214760 | 95 | As is | by resynthesis (? - ? days) |
| P-872724345 | 98 | As is | in stock |
| P-1264048401 | 98 | As is | in stock |
| P-893515624 | 90 | As is | 4.541 g |
| P-1270364360 | 99 | As is | in stock |
| P-901179046 | N/A | As is | in stock |
| P-489149540 | 97 | As is | in stock |
| P-905462235 | 95 | As is | in stock |
| P-868544409 | 98 | As is | in stock |
| P-901916848 | 99 | As is | 468 mg |
| P-851278468 | 95 | As is | by synthesis |
| P-860798218 | 98 | As is | in stock |
| P-675216105 | 95 | As is | in stock |
| P-854721916 | 95 | As is | in stock |
| P-584619539 | 95 | As is | in stock |
| P-608280101 | 98 | As is | in stock |
| P-579711239 | 98 | As is | in stock |
| P-611464022 | 90 | As is | in stock |
| P-1271662962 | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 449.251 |
| logP | 5.1661 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 76.14 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 102.5999 |
| Atoms | 46 |
| Rings | 3 |
| Heavy atoms | 29 |
| Hydrogen atoms | 17 |
| Heteroatoms | 11 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 5 |
| 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 |
