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MCULE-7641082249-0
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 | 29 USD | 98 | 16 working days | Get Quote |
| 5 mg | 47 USD | 98 | 16 working days | Get Quote |
| 10 mg | 68 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-7641082249-0.sdf |
| SMILES | MCULE-7641082249-0.smiles |
| Standard InChI | MCULE-7641082249-0.inchi |
| InChIKey | MCULE-7641082249-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1264047046 | 99 | As is | in stock |
| P-893473142 | 90 | As is | 7.513 g |
| P-489195039 | 97 | As is | in stock |
| P-580732165 | 98 | As is | 12 mg |
| P-851278111 | 95 | As is | by synthesis |
| P-887182568 | 95 | As is | by synthesis |
| P-579478467 | 95 | As is | in stock |
| P-854721883 | 95 | As is | in stock |
| P-1263153559 | 95 | As is | by synthesis |
| P-474021336 | 95 | As is | in stock |
| P-608277329 | 98 | As is | in stock |
| P-620945519 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 576.615 |
| logP | 5.4765 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 10 |
| PSA | 99.17 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 158.1849 |
| Atoms | 73 |
| Rings | 5 |
| Heavy atoms | 42 |
| Hydrogen atoms | 31 |
| Heteroatoms | 12 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
