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UNKNOWN STEREO
MCULE-3642125734-0
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 | 20 USD | 98 | 22 working days | Get Quote |
| 5 mg | 40 USD | 95 | 7 working days | Get Quote |
| 10 mg | 67 USD | 95 | 7 working days | Get Quote |
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1
MCULE-6122044472-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3642125734-0.sdf |
| SMILES | MCULE-3642125734-0.smiles |
| Standard InChI | MCULE-3642125734-0.inchi |
| InChIKey | MCULE-3642125734-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892259131 | 95 | As is | unavailable |
| P-892341538 | 95 | As is | unavailable |
| P-611492389 | 90 | As is | in stock |
| P-867537484 | 98 | Main component | in stock |
| P-875693188 | 98 | Main component | in stock |
| P-1275172045 | 98 | Main component | in stock |
| P-606860170 | N/A | Main component | in stock |
| P-865902717 | N/A | Main component | 100 mg |
| P-905460028 | 95 | Main component | in stock |
| P-872868343 | 99 | Main component | in stock |
| P-860799885 | 98 | Main component | in stock |
| P-675217640 | 95 | Main component | in stock |
| P-892293902 | 95 | Main component | unavailable |
| P-869158493 | 95 | Main component | 150 mg |
| P-888654280 | 95 | Main component | 150 mg |
| P-855357373 | 90 | Main component | in stock |
| P-872751321 | 98 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 492.366 |
| logP | 5.1708 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 78.1 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 123.8772 |
| Atoms | 52 |
| Rings | 4 |
| Heavy atoms | 31 |
| Hydrogen atoms | 21 |
| Heteroatoms | 11 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| 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 |
