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UNKNOWN STEREO
MCULE-4199529498
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 | 117 USD | 95 | 22 working days | Get Quote |
| 5 mg | 424 USD | 95 | 25 working days | Get Quote |
| 10 mg | 565 USD | 95 | 25 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-2758172825
- Component type: Main
-
1
MCULE-1176533515
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4199529498.sdf |
| SMILES | MCULE-4199529498.smiles |
| Standard InChI | MCULE-4199529498.inchi |
| InChIKey | MCULE-4199529498.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892891048 | 95 | As is | in stock |
| P-890192937 | N/A | As is | in stock |
| P-892862199 | 97 | Main component as a main component | in stock |
| P-612923210 | N/A | Main component as a main component | by synthesis |
| P-901268931 | N/A | Main component as a main component | in stock |
| P-890142441 | N/A | Main component as a main component | in stock |
| P-613846053 | 95 | Main component as a main component | in stock |
| P-869309924 | 95 | Main component as a main component | in stock |
| P-891661072 | N/A | Main component as a main component | by synthesis |
| P-905019929 | N/A | Main component as a main component | by synthesis |
| P-881653705 | 98 | Main component as a main component | in stock |
| P-889521530 | 95 | Main component as a main component | by synthesis |
| P-905449725 | 95 | Main component as a main component | by synthesis |
| P-901427456 | 95 | Main component as a main component | by synthesis |
| P-901461151 | 95 | Main component as a main component | by synthesis |
| P-505620300 | 98 | Main component as a main component | in stock |
| P-505616268 | 95 | Main component as a main component | in stock |
| P-869131319 | 95 | Main component as a main component | by synthesis |
| P-888642577 | 95 | Main component as a main component | unavailable |
| P-611356554 | 90 | Main component as a main component | in stock |
| P-855028685 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 345.456 |
| logP | 2.2108 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 95.04 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 87.2996 |
| Atoms | 50 |
| Rings | 2 |
| Heavy atoms | 23 |
| Hydrogen atoms | 27 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
