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MCULE-7690964052-0
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 | 71 USD | 99 | 12 working days | Get Quote |
| 5 mg | 71 USD | 99 | 12 working days | Get Quote |
| 10 mg | 113 USD | 99 | 12 working days | Get Quote |
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1
MCULE-1178830319-1
- Component type: Main
-
1
MCULE-8295936189-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7690964052-0.sdf |
| SMILES | MCULE-7690964052-0.smiles |
| Standard InChI | MCULE-7690964052-0.inchi |
| InChIKey | MCULE-7690964052-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1264050908 | 99 | Main component | in stock |
| P-489136888 | 97 | Main component | in stock |
| P-901560411 | 95 | Main component | by synthesis |
| P-893220679 | 95 | Main component | in stock |
| P-861286418 | 98 | Main component | in stock |
| P-889866843 | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 892.019 |
| logP | 1.7193 |
| H-bond acceptors | 22 |
| H-bond donors | 11 |
| Rotatable bonds | 10 |
| PSA | 414.29 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 248.074 |
| Atoms | 114 |
| Rings | 4 |
| Heavy atoms | 61 |
| Hydrogen atoms | 53 |
| Heteroatoms | 24 |
| N/O atoms | 22 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 5 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
