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MCULE-5939443834-0
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 | 179 USD | 96 | 12 working days | Get Quote |
| 5 mg | 179 USD | 96 | 12 working days | Get Quote |
| 10 mg | 179 USD | 96 | 12 working days | Get Quote |
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MCULE-6229726410-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5939443834-0.sdf |
| SMILES | MCULE-5939443834-0.smiles |
| Standard InChI | MCULE-5939443834-0.inchi |
| InChIKey | MCULE-5939443834-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-597015606 | 95 | As is | unavailable |
| P-853428075 | 98 | As is | by resynthesis (? - ? days) |
| P-851901126 | N/A | As is | by synthesis |
| P-591162127 | 95 | As is | by synthesis |
| P-500152138 | 96 | As is | in stock |
| P-579676258 | 95 | As is | by resynthesis (? - ? days) |
| P-864070749 | 95 | As is | by synthesis |
| P-667010377 | 95 | As is | in stock |
| P-853428267 | 98 | As a main component | by resynthesis (? - ? days) |
| P-851498297 | N/A | As a main component | by synthesis |
| P-590777097 | 98 | As a main component | by synthesis |
| P-851290158 | 95 | As a main component | by synthesis |
| P-500152139 | 96 | As a main component | in stock |
| P-854940206 | 95 | As a main component | by synthesis |
| P-611446345 | 90 | As a main component | in stock |
| P-615461228 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 176.258 |
| logP | 3.1133 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 49.87 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 57.0931 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
