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MCULE-7458599436
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.
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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 | 32 USD | 95 | 7 working days | Get Quote |
| 5 mg | 50 USD | 95 | 7 working days | Get Quote |
| 10 mg | 74 USD | 95 | 7 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-5574130021
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7458599436.sdf |
| SMILES | MCULE-7458599436.smiles |
| Standard InChI | MCULE-7458599436.inchi |
| InChIKey | MCULE-7458599436.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892944492 | N/A | As is | by synthesis |
| P-872839940 | 95 | As a main component | in stock |
| P-893605097 | 90 | As a main component | 13.81 g |
| P-891658930 | N/A | As a main component | by synthesis |
| P-881117471 | 95 | As a main component | 10 g |
| P-889850590 | 95 | As a main component | by synthesis |
| P-893248265 | 95 | As a main component | by synthesis |
| P-427976892 | 90 | As a main component | 100 mg |
| P-873243263 | 97 | As a main component | 5 mg |
| P-896171843 | 90 | As a main component | 8 mg |
| P-892214991 | 95 | As a main component | by synthesis |
| P-892287319 | 95 | As a main component | unavailable |
| P-892311268 | 95 | As a main component | 102 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 255.227 |
| logP | -0.3357 |
| H-bond acceptors | 8 |
| H-bond donors | 6 |
| Rotatable bonds | 5 |
| PSA | 148.4 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 62.4539 |
| Atoms | 31 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 13 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
