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MCULE-9554206504-0
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 | 20 USD | 98 | 11 working days | Get Quote |
| 5 mg | 20 USD | 98 | 11 working days | Get Quote |
| 10 mg | 20 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9554206504-0.sdf |
| SMILES | MCULE-9554206504-0.smiles |
| Standard InChI | MCULE-9554206504-0.inchi |
| InChIKey | MCULE-9554206504-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893524111 | 90 | As is | 19.33 g |
| P-25946829 | 70 | As is | 100 mg |
| P-900154604 | 95 | As is | in stock |
| P-452652405 | 98 | As is | in stock |
| P-1272277163 | 95 | As is | by synthesis |
| P-887195050 | 95 | As is | by synthesis |
| P-579478004 | 95 | As is | in stock |
| P-854692687 | 95 | As is | in stock |
| P-905144832 | 95 | As is | in stock |
| P-608279737 | 98 | As is | in stock |
| P-617402922 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 346.329 |
| logP | -2.8015 |
| H-bond acceptors | 9 |
| H-bond donors | 6 |
| Rotatable bonds | 4 |
| PSA | 149.07 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 77.1548 |
| Atoms | 46 |
| Rings | 3 |
| Heavy atoms | 24 |
| Hydrogen atoms | 22 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 9 |
| R/S chiral centers | 9 |
| 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 |
