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MCULE-4133679262-0
Structure
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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 | 69 USD | 95 | 15 working days | Get Quote |
| 5 mg | 171 USD | 98 | 16 working days | Get Quote |
| 10 mg | 268 USD | 95 | 15 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4133679262-0.sdf |
| SMILES | MCULE-4133679262-0.smiles |
| Standard InChI | MCULE-4133679262-0.inchi |
| InChIKey | MCULE-4133679262-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903056791 | 95 | As is | 75 mg |
| P-893608146 | 90 | As is | 333 mg |
| P-580720957 | 95 | As is | 54 mg |
| P-1275107542 | N/A | As is | by resynthesis (? - ? days) |
| P-881633854 | 98 | As is | in stock |
| P-851249290 | 95 | As is | by synthesis |
| P-1263257789 | 95 | As is | by synthesis |
| P-579478796 | 95 | As is | in stock |
| P-854621105 | 98 | As is | in stock |
| P-1272597874 | 95 | As is | 5 mg |
| P-852523077 | 95 | As is | by synthesis |
| P-854721226 | 95 | As is | in stock |
| P-905144968 | 95 | As is | by synthesis |
| P-905147477 | 95 | As is | by synthesis |
| P-474027649 | 95 | As is | in stock |
| P-608275815 | 98 | As is | in stock |
| P-579710774 | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 721.861 |
| logP | 9.087 |
| H-bond acceptors | 10 |
| H-bond donors | 4 |
| Rotatable bonds | 18 |
| PSA | 168.45 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 200.3677 |
| Atoms | 95 |
| Rings | 6 |
| Heavy atoms | 52 |
| Hydrogen atoms | 43 |
| Heteroatoms | 11 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
