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MCULE-3174866493
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 | 28 USD | 98 | 16 working days | Get Quote |
| 5 mg | 28 USD | 98 | 16 working days | Get Quote |
| 10 mg | 28 USD | 98 | 16 working days | Get Quote |
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1
MCULE-2105037973
- Component type: Main
-
2
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3174866493.sdf |
| SMILES | MCULE-3174866493.smiles |
| Standard InChI | MCULE-3174866493.inchi |
| InChIKey | MCULE-3174866493.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-616205668 | 97 | As is | 8.6 g |
| P-868596924 | 98 | As is | in stock |
| P-900267136 | 95 | As is | in stock |
| P-619672516 | 98 | As is | in stock |
| P-890238901 | 99 | Main component | 1.9 g |
| P-1263293053 | 97 | Main component | in stock |
| P-906838719 | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 610.265 |
| logP | -3.9173 |
| H-bond acceptors | 19 |
| H-bond donors | 7 |
| Rotatable bonds | 9 |
| PSA | 322.27 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 105.4085 |
| Atoms | 60 |
| Rings | 3 |
| Heavy atoms | 38 |
| Hydrogen atoms | 22 |
| Heteroatoms | 23 |
| N/O atoms | 19 |
| Inorganic atoms | 2 |
| Halogen atoms | 0 |
| Chiral centers | 9 |
| R/S chiral centers | 9 |
| 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 |
