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MCULE-5295516947
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 | 91 USD | 98 | 14 working days | Get Quote |
| 5 mg | 114 USD | 98 | 22 working days | Get Quote |
| 10 mg | 211 USD | 98 | 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-3463118461
- Component type: Main
-
1
MCULE-9976402631
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5295516947.sdf |
| SMILES | MCULE-5295516947.smiles |
| Standard InChI | MCULE-5295516947.inchi |
| InChIKey | MCULE-5295516947.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903014022 | 98 | Main component | 200 mg |
| P-905499956 | N/A | Main component | in stock |
| P-888172178 | 98 | Main component | by synthesis |
| P-906879353 | 98 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 896.905 |
| logP | 3.1062 |
| H-bond acceptors | 20 |
| H-bond donors | 11 |
| Rotatable bonds | 29 |
| PSA | 338.54 |
| RO5 violations | 3 |
| RO3 violations | 6 |
| Refractivity | 217.1806 |
| Atoms | 118 |
| Rings | 2 |
| Heavy atoms | 63 |
| Hydrogen atoms | 55 |
| Heteroatoms | 23 |
| N/O atoms | 20 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 6 |
| R/S chiral centers | 6 |
| 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 |
