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MCULE-4096477644
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 | 1522 USD | 95 | 35 working days | Get Quote |
| 5 mg | 1522 USD | 95 | 35 working days | Get Quote |
| 10 mg | 2435 USD | 95 | 35 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4096477644.sdf |
| SMILES | MCULE-4096477644.smiles |
| Standard InChI | MCULE-4096477644.inchi |
| InChIKey | MCULE-4096477644.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-851739233 | N/A | As is | by synthesis |
| P-890232244 | 99 | As is | by synthesis |
| P-901446700 | 95 | As is | by synthesis |
| P-854706591 | 95 | As is | by synthesis |
| P-869119396 | 95 | As is | unavailable |
| P-888634320 | 95 | As is | unavailable |
| P-1279321569 | 99 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 389.511 |
| logP | 6.1753 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 7 |
| PSA | 59.59 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 115.441 |
| Atoms | 51 |
| Rings | 4 |
| Heavy atoms | 28 |
| Hydrogen atoms | 23 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
