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UNKNOWN STEREO
MCULE-2549773794
Compound
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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 | 31 USD | 97 | 19 working days | Get Quote |
| 5 mg | 31 USD | 97 | 19 working days | Get Quote |
| 10 mg | 31 USD | 97 | 19 working days | Get Quote |
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1
MCULE-6863137426
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2549773794.sdf |
| SMILES | MCULE-2549773794.smiles |
| Standard InChI | MCULE-2549773794.inchi |
| InChIKey | MCULE-2549773794.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1275179597 | 97 | As is | in stock |
| P-864203097 | 95 | As is | in stock |
| P-872868197 | 99 | As is | in stock |
| P-580450363 | 26 | As is | in stock |
| P-854555130 | 92 | As is | 157 mg |
| P-666970401 | 97 | As is | in stock |
| P-1270153514 | 98 | Main component | in stock |
| P-1268835276 | 98 | Main component | in stock |
| P-905008830 | N/A | Main component | by synthesis |
| P-1272010731 | 98 | Main component | 250 mg |
| P-904251435 | 95 | Main component | unavailable |
| P-892256850 | 95 | Main component | 50 mg |
| P-892340451 | 95 | Main component | 50 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 423.420 |
| logP | 0.8894 |
| H-bond acceptors | 8 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 140.87 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 103.7917 |
| Atoms | 47 |
| Rings | 4 |
| Heavy atoms | 29 |
| Hydrogen atoms | 18 |
| Heteroatoms | 10 |
| N/O atoms | 8 |
| Inorganic atoms | 1 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
