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UNKNOWN STEREO
MCULE-2236429609-0
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 | 10 USD | 97 | 20 working days | Get Quote |
| 5 mg | 10 USD | 97 | 20 working days | Get Quote |
| 10 mg | 10 USD | 97 | 20 working days | Get Quote |
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1
MCULE-5832256269-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2236429609-0.sdf |
| SMILES | MCULE-2236429609-0.smiles |
| Standard InChI | MCULE-2236429609-0.inchi |
| InChIKey | MCULE-2236429609-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867586522 | 97 | As is | in stock |
| P-875745942 | 97 | As is | in stock |
| P-1275169713 | 98 | As is | in stock |
| P-606843389 | N/A | As is | in stock |
| P-596954741 | 97 | As is | 25 g |
| P-864166220 | 97 | As is | in stock |
| P-611380171 | 90 | As is | in stock |
| P-892852846 | 98 | Main component | in stock |
| P-901255658 | 98 | Main component | in stock |
| P-869365550 | 95 | Main component | by resynthesis (? - ? days) |
| P-904029875 | N/A | Main component | by synthesis |
| P-888813775 | 98 | Main component | 15 g |
| P-889849840 | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 330.806 |
| logP | 4.2834 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 68.11 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 93.1301 |
| Atoms | 42 |
| Rings | 3 |
| Heavy atoms | 23 |
| Hydrogen atoms | 19 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
