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UNKNOWN STEREO
MCULE-3734099554
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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 USD | 98 | 20 working days | Get Quote |
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1
MCULE-9369985261
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3734099554.sdf |
| SMILES | MCULE-3734099554.smiles |
| Standard InChI | MCULE-3734099554.inchi |
| InChIKey | MCULE-3734099554.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-851811764 | N/A | As is | by synthesis |
| P-872712570 | N/A | Main component | by synthesis |
| P-500407900 | N/A | Main component | by synthesis |
| P-500382004 | 95 | Main component | by synthesis |
| P-611518536 | 90 | Main component | in stock |
| P-875830153 | 90 | Main component as a main component | in stock |
| P-1275164847 | 98 | Main component as a main component | in stock |
| P-1270397756 | 98 | Main component as a main component | in stock |
| P-1270373178 | N/A | Main component as a main component | in stock |
| P-851946590 | N/A | Main component as a main component | in stock |
| P-851948441 | N/A | Main component as a main component | in stock |
| P-865926504 | 98 | Main component as a main component | 100 g |
| P-864208985 | 95 | Main component as a main component | in stock |
| P-864138341 | 93 | Main component as a main component | in stock |
| P-893243012 | 95 | Main component as a main component | in stock |
| P-893243028 | 95 | Main component as a main component | in stock |
| P-675216474 | 95 | Main component as a main component | in stock |
| P-675212828 | 95 | Main component as a main component | in stock |
| P-675216475 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 545.163 |
| logP | -1.3163 |
| H-bond acceptors | 19 |
| H-bond donors | 7 |
| Rotatable bonds | 8 |
| PSA | 331.36 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 96.6981 |
| Atoms | 48 |
| Rings | 3 |
| Heavy atoms | 33 |
| Hydrogen atoms | 15 |
| Heteroatoms | 23 |
| N/O atoms | 19 |
| Inorganic atoms | 1 |
| 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 |
