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UNKNOWN STEREO
MCULE-1173589699
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 | 30 USD | 95 | 7 working days | Get Quote |
| 5 mg | 30 USD | 95 | 7 working days | Get Quote |
| 10 mg | 30 USD | 95 | 7 working days | Get Quote |
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1
MCULE-2953264073
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1173589699.sdf |
| SMILES | MCULE-1173589699.smiles |
| Standard InChI | MCULE-1173589699.inchi |
| InChIKey | MCULE-1173589699.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266373454 | 98 | As is | by synthesis |
| P-893238463 | 95 | As is | in stock |
| P-611493453 | 90 | As is | in stock |
| P-886576685 | N/A | Main component | in stock |
| P-890149003 | N/A | Main component | in stock |
| P-596959995 | 95 | Main component | 1.8 g |
| P-864174706 | 95 | Main component | in stock |
| P-869176002 | 95 | Main component | in stock |
| P-892290987 | 95 | Main component | unavailable |
| P-892228610 | 95 | Main component | 150 mg |
| P-892321968 | 95 | Main component | 150 mg |
| P-611364199 | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 798.851 |
| logP | 3.9229 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 95.61 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 122.9659 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 25 |
| Hydrogen atoms | 10 |
| Heteroatoms | 10 |
| N/O atoms | 5 |
| Inorganic atoms | 1 |
| Halogen atoms | 4 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
