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MCULE-9402448793
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 | 36 USD | 98 | 16 working days | Get Quote |
| 5 mg | 36 USD | 98 | 16 working days | Get Quote |
| 10 mg | 36 USD | 98 | 16 working days | Get Quote |
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1
MCULE-7563141222
- Component type: Main
-
4
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9402448793.sdf |
| SMILES | MCULE-9402448793.smiles |
| Standard InChI | MCULE-9402448793.inchi |
| InChIKey | MCULE-9402448793.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-905489171 | 95 | As is | 10 g |
| P-1274452950 | 90 | As is | 1.02523 kg |
| P-871218589 | N/A | As is | by resynthesis (? - ? days) |
| P-870586822 | 97 | As is | in stock |
| P-856078898 | 95 | As is | in stock |
| P-871072233 | 95 | As is | in stock |
| P-901917512 | 98 | Main component | 6.3 g |
| P-895170523 | 95 | Main component | in stock |
| P-871072232 | 95 | Main component | in stock |
| P-893606184 | 90 | Main component as a main component | 7.798 g |
| P-619597383 | 90 | Main component as a main component | by synthesis |
| P-871072231 | 95 | Main component as a main component | in stock |
| P-878643042 | 98 | Main component as a main component | in stock |
| P-906901672 | 96 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 5 |
| Mass | 833.348 |
| logP | 0.4028 |
| H-bond acceptors | 24 |
| H-bond donors | 5 |
| Rotatable bonds | 13 |
| PSA | 404.9 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 150.0267 |
| Atoms | 78 |
| Rings | 5 |
| Heavy atoms | 52 |
| Hydrogen atoms | 26 |
| Heteroatoms | 31 |
| N/O atoms | 24 |
| Inorganic atoms | 4 |
| Halogen atoms | 0 |
| Chiral centers | 8 |
| R/S chiral centers | 8 |
| 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 |
