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UNKNOWN STEREO
MCULE-1272017934
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 | 45 USD | 95 | 22 working days | Get Quote |
| 5 mg | 137 USD | 95 | 22 working days | Get Quote |
| 10 mg | 250 USD | 95 | 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-2044825561
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1272017934.sdf |
| SMILES | MCULE-1272017934.smiles |
| Standard InChI | MCULE-1272017934.inchi |
| InChIKey | MCULE-1272017934.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867291864 | N/A | As is | by synthesis |
| P-901185053 | N/A | As is | by synthesis |
| P-867558112 | 95 | Main component | in stock |
| P-875717591 | N/A | Main component | in stock |
| P-869196124 | 98 | Main component | in stock |
| P-851546622 | N/A | Main component | by synthesis |
| P-865906761 | 93 | Main component | 10 mg |
| P-889520269 | 95 | Main component | by synthesis |
| P-893240076 | 95 | Main component | in stock |
| P-869159695 | 95 | Main component | by synthesis |
| P-888655196 | 95 | Main component | 4 mg |
| P-611420818 | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 313.236 |
| logP | -4.0104 |
| H-bond acceptors | 9 |
| H-bond donors | 5 |
| Rotatable bonds | 6 |
| PSA | 159.38 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 60.9664 |
| Atoms | 37 |
| Rings | 1 |
| Heavy atoms | 21 |
| Hydrogen atoms | 16 |
| Heteroatoms | 10 |
| N/O atoms | 9 |
| Inorganic atoms | 1 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 5 |
| 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 |
