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UNKNOWN STEREO
MCULE-6789649463-0
Structure
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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 | 140 USD | 95 | 22 working days | Get Quote |
| 5 mg | 240 USD | 95 | 22 working days | Get Quote |
| 10 mg | 361 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-1309293971-1
- Component type: Main
-
1
MCULE-8295936189-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6789649463-0.sdf |
| SMILES | MCULE-6789649463-0.smiles |
| Standard InChI | MCULE-6789649463-0.inchi |
| InChIKey | MCULE-6789649463-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867643318 | 95 | As is | in stock |
| P-875809913 | N/A | As is | in stock |
| P-881108577 | 99 | As is | 25 mg |
| P-896041367 | 95 | As is | by synthesis |
| P-867673395 | 95 | Main component | in stock |
| P-875847634 | N/A | Main component | in stock |
| P-892301883 | 95 | Main component | unavailable |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 2993.491 |
| logP | 6.8324 |
| H-bond acceptors | 73 |
| H-bond donors | 43 |
| Rotatable bonds | 119 |
| PSA | 1221.32 |
| RO5 violations | 4 |
| RO3 violations | 6 |
| Refractivity | 789.4658 |
| Atoms | 426 |
| Rings | 9 |
| Heavy atoms | 212 |
| Hydrogen atoms | 214 |
| Heteroatoms | 74 |
| N/O atoms | 73 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 22 |
| R/S chiral centers | 22 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 3 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 3 |
| Undefined stereo double bonds | 0 |
