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MCULE-5283512067
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 | 151 USD | 98 | 16 working days | Get Quote |
| 5 mg | 151 USD | 98 | 16 working days | Get Quote |
| 10 mg | 252 USD | 98 | 16 working days | Get Quote |
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1
MCULE-1824218474
- Component type: Main
-
1
MCULE-9976402631
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5283512067.sdf |
| SMILES | MCULE-5283512067.smiles |
| Standard InChI | MCULE-5283512067.inchi |
| InChIKey | MCULE-5283512067.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-878643702 | 98 | As is | in stock |
| P-905500542 | N/A | Main component | in stock |
| P-900260932 | 98 | Main component | by synthesis |
| P-893609780 | 90 | Main component as a main component | 200 mg |
| P-893609783 | 90 | Main component as a main component | 200 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 1146.218 |
| logP | 2.2897 |
| H-bond acceptors | 26 |
| H-bond donors | 13 |
| Rotatable bonds | 37 |
| PSA | 415.2 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 294.5925 |
| Atoms | 155 |
| Rings | 5 |
| Heavy atoms | 81 |
| Hydrogen atoms | 74 |
| Heteroatoms | 29 |
| N/O atoms | 26 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 8 |
| R/S chiral centers | 8 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |
