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MCULE-3333656572
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 | 325 USD | 90 | 22 working days | Get Quote |
| 5 mg | 325 USD | 90 | 22 working days | Get Quote |
| 10 mg | 328 USD | 90 | 22 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-5624261535
- Component type: Main
-
1
MCULE-9920754312
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3333656572.sdf |
| SMILES | MCULE-3333656572.smiles |
| Standard InChI | MCULE-3333656572.inchi |
| InChIKey | MCULE-3333656572.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-610973643 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 100 mg |
| P-610973642 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 7.458 g |
| P-579479190 | DC Chemicals Limited | Stock Products | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 558.554 |
| logP | 1.8648 |
| H-bond acceptors | 12 |
| H-bond donors | 6 |
| Rotatable bonds | 9 |
| PSA | 181.29 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 149.573 |
| Atoms | 71 |
| Rings | 4 |
| Heavy atoms | 40 |
| Hydrogen atoms | 31 |
| Heteroatoms | 13 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 2 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 2 |
| Undefined stereo double bonds | 0 |
