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UNKNOWN STEREO
MCULE-8198837944
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 | 136 USD | 95 | 12 working days | Get Quote |
| 5 mg | 510 USD | 97 | 27 working days | Get Quote |
| 10 mg | 819 USD | 97 | 27 working days | Get Quote |
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1
MCULE-9617197044
- Component type: Main
-
1
MCULE-7903544426
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8198837944.sdf |
| SMILES | MCULE-8198837944.smiles |
| Standard InChI | MCULE-8198837944.inchi |
| InChIKey | MCULE-8198837944.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-889497728 | 95 | As is | by synthesis |
| P-904258219 | 95 | As is | in stock |
| P-904252676 | 95 | As is | unavailable |
| P-904223846 | 95 | As is | 5 mg |
| P-904239769 | 95 | As is | 5 mg |
| P-1265610932 | N/A | Main component | by synthesis |
| P-874643498 | 97 | Main component | by resynthesis (? - ? days) |
| P-1274629133 | N/A | Main component | unavailable |
| P-892251900 | 95 | Main component | unavailable |
| P-892336997 | 95 | Main component | unavailable |
| P-1274334221 | 95 | Main component as a main component | unavailable |
| P-1274343308 | 95 | Main component as a main component | 549 mg |
| P-1274354964 | 95 | Main component as a main component | 549 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 541.828 |
| logP | 7.5893 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 95.45 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 154.7046 |
| Atoms | 92 |
| Rings | 4 |
| Heavy atoms | 37 |
| Hydrogen atoms | 55 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| 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 |
