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MCULE-2542656329
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 | 40 USD | 98 | 22 working days | Get Quote |
| 5 mg | 63 USD | 98 | 22 working days | Get Quote |
| 10 mg | 126 USD | 98 | 22 working days | Get Quote |
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MCULE-6611683076
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2542656329.sdf |
| SMILES | MCULE-2542656329.smiles |
| Standard InChI | MCULE-2542656329.inchi |
| InChIKey | MCULE-2542656329.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-874604933 | 95 | As is | by resynthesis (? - ? days) |
| P-608495508 | 95 | As is | in stock |
| P-596584327 | 97 | As is | 1 mg |
| P-888169737 | 98 | As is | by synthesis |
| P-889883743 | 95 | As is | by synthesis |
| P-608495502 | 95 | As a main component | in stock |
| P-873252159 | 97 | As a main component | 5 mg |
| P-888169738 | 98 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 562.706 |
| logP | 2.9154 |
| H-bond acceptors | 11 |
| H-bond donors | 2 |
| Rotatable bonds | 10 |
| PSA | 120.16 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 174.1926 |
| Atoms | 83 |
| Rings | 5 |
| Heavy atoms | 41 |
| Hydrogen atoms | 42 |
| Heteroatoms | 11 |
| N/O atoms | 11 |
| 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 |
