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UNKNOWN STEREO
MCULE-3664838505-0
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 | 49 USD | N/A | 9 working days | Get Quote |
| 5 mg | 101 USD | N/A | 9 working days | Get Quote |
| 10 mg | 166 USD | N/A | 9 working days | Get Quote |
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1
MCULE-5049717483-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3664838505-0.sdf |
| SMILES | MCULE-3664838505-0.smiles |
| Standard InChI | MCULE-3664838505-0.inchi |
| InChIKey | MCULE-3664838505-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-869332958 | 95 | As is | by resynthesis (? - ? days) |
| P-1270396331 | 98 | As is | in stock |
| P-851947093 | N/A | As is | in stock |
| P-864207118 | 95 | As is | in stock |
| P-860799361 | 98 | As is | in stock |
| P-675215976 | 95 | As is | in stock |
| P-480967587 | 98 | As is | in stock |
| P-1266085297 | 95 | Main component | in stock |
| P-1265811898 | 95 | Main component | in stock |
| P-869361622 | 95 | Main component | by resynthesis (? - ? days) |
| P-851515652 | N/A | Main component | by synthesis |
| P-892189702 | 95 | Main component | 100 mg |
| P-905469252 | 95 | Main component | in stock |
| P-1274334481 | 95 | Main component | unavailable |
| P-892258095 | 95 | Main component | 478 mg |
| P-892341048 | 95 | Main component | 474 mg |
| P-1271620516 | 95 | Main component | in stock |
| P-901546832 | 95 | Main component as a main component | by synthesis |
| P-1273111347 | 95 | Main component as a main component | 100 mg |
| P-892252141 | 95 | Main component as a main component | unavailable |
| P-892337151 | 95 | Main component as a main component | unavailable |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 484.078 |
| logP | 5.0133 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 13 |
| PSA | 157.55 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 134.3063 |
| Atoms | 61 |
| Rings | 2 |
| Heavy atoms | 31 |
| Hydrogen atoms | 30 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
