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MCULE-6991304318
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 | 186 USD | 97 | 15 working days | Get Quote |
| 5 mg | 186 USD | 97 | 15 working days | Get Quote |
| 10 mg | 186 USD | 97 | 15 working days | Get Quote |
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1
MCULE-6990365127
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6991304318.sdf |
| SMILES | MCULE-6991304318.smiles |
| Standard InChI | MCULE-6991304318.inchi |
| InChIKey | MCULE-6991304318.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892412174 | BLD pharm | In-stock building blocks | 97 | As is | 170 mg |
| P-895181504 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-871075515 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-871075514 | MedKoo | In stock compounds | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 489.960 |
| logP | 7.065 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 12 |
| PSA | 101.26 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 127.0311 |
| Atoms | 64 |
| Rings | 3 |
| Heavy atoms | 33 |
| Hydrogen atoms | 31 |
| Heteroatoms | 11 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |
