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MCULE-1353591444
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 | 13 USD | 98 | 24 working days | Get Quote |
| 5 mg | 13 USD | 98 | 24 working days | Get Quote |
| 10 mg | 13 USD | 98 | 24 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-2506907954
- Component type: Main
-
1
MCULE-1113222985
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1353591444.sdf |
| SMILES | MCULE-1353591444.smiles |
| Standard InChI | MCULE-1353591444.inchi |
| InChIKey | MCULE-1353591444.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875715147 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-666956718 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-505575244 | Bosche Scientific | Bosche Products | 98 | As is | in stock |
| P-861344559 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-854712967 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474027172 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-890140388 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-500415560 | AvaChem Scientific | All products | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 417.459 |
| logP | 3.4079 |
| H-bond acceptors | 10 |
| H-bond donors | 6 |
| Rotatable bonds | 11 |
| PSA | 159.89 |
| RO5 violations | 1 |
| RO3 violations | 6 |
| Refractivity | 115.8894 |
| Atoms | 57 |
| Rings | 2 |
| Heavy atoms | 30 |
| Hydrogen atoms | 27 |
| Heteroatoms | 10 |
| N/O atoms | 10 |
| 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 | 3 |
| Cis/trans stereo double bonds | 2 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |
