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UNKNOWN STEREO
MCULE-4580888649-1
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 | 23 USD | N/A | 9 working days | Get Quote |
| 5 mg | 23 USD | N/A | 9 working days | Get Quote |
| 10 mg | 23 USD | N/A | 9 working days | Get Quote |
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1
MCULE-2395659873-0
- Component type: Main
-
2
MCULE-7654331405-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4580888649-1.sdf |
| SMILES | MCULE-4580888649-1.smiles |
| Standard InChI | MCULE-4580888649-1.inchi |
| InChIKey | MCULE-4580888649-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1275197787 | 95 | As is | in stock |
| P-851608582 | N/A | As is | by synthesis |
| P-864170138 | 95 | As is | in stock |
| P-901507435 | 95 | As is | by synthesis |
| P-855093186 | 90 | As is | in stock |
| P-1275176095 | 98 | Main component | in stock |
| P-1275151530 | 95 | Main component | in stock |
| P-881654411 | 98 | Main component | in stock |
| P-1270320189 | 95 | Main component | in stock |
| P-606861132 | N/A | Main component | in stock |
| P-864153027 | 95 | Main component | in stock |
| P-893242227 | 95 | Main component | in stock |
| P-901507467 | 95 | Main component | by synthesis |
| P-861285874 | 95 | Main component | in stock |
| P-580418409 | 95 | Main component | by resynthesis (? - ? days) |
| P-675216898 | 95 | Main component | in stock |
| P-500382009 | 95 | Main component | by synthesis |
| P-869175878 | 95 | Main component | in stock |
| P-892225237 | 95 | Main component | 894 mg |
| P-892289794 | 95 | Main component | 666 mg |
| P-892319133 | 95 | Main component | 666 mg |
| P-611348704 | 90 | Main component | in stock |
| P-1271673870 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 625.550 |
| logP | 2.7914 |
| H-bond acceptors | 17 |
| H-bond donors | 8 |
| Rotatable bonds | 6 |
| PSA | 304.26 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 147.5932 |
| Atoms | 82 |
| Rings | 5 |
| Heavy atoms | 41 |
| Hydrogen atoms | 41 |
| Heteroatoms | 19 |
| N/O atoms | 17 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
