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UNKNOWN STEREO
MCULE-8990435279-0
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 | 319 USD | 95 | 12 working days | Get Quote |
| 5 mg | 768 USD | 95 | 12 working days | Get Quote |
| 10 mg | 1056 USD | 95 | 12 working days | Get Quote |
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1
MCULE-1977017028-0
- Component type: Main
-
2
MCULE-9976402631-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8990435279-0.sdf |
| SMILES | MCULE-8990435279-0.smiles |
| Standard InChI | MCULE-8990435279-0.inchi |
| InChIKey | MCULE-8990435279-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-854989716 | 90 | As is | in stock |
| P-892890050 | N/A | Main component as a main component | in stock |
| P-901313689 | N/A | Main component as a main component | in stock |
| P-895113223 | N/A | Main component as a main component | 25 mg |
| P-904249765 | 95 | Main component as a main component | unavailable |
| P-892250346 | 95 | Main component as a main component | 32 mg |
| P-892335961 | 95 | Main component as a main component | 32 mg |
| P-611495594 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 699.596 |
| logP | 4.9555 |
| H-bond acceptors | 12 |
| H-bond donors | 8 |
| Rotatable bonds | 6 |
| PSA | 205.22 |
| RO5 violations | 3 |
| RO3 violations | 6 |
| Refractivity | 164.9639 |
| Atoms | 80 |
| Rings | 8 |
| Heavy atoms | 49 |
| Hydrogen atoms | 31 |
| Heteroatoms | 18 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| Halogen atoms | 6 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
