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UNKNOWN STEREO
MCULE-9252868508
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 | 282 USD | 98 | 22 working days | Get Quote |
| 5 mg | 741 USD | 98 | 22 working days | Get Quote |
| 10 mg | 1200 USD | 98 | 22 working days | Get Quote |
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2
MCULE-8948605862
- Component type: Main
-
1
MCULE-9163528685
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9252868508.sdf |
| SMILES | MCULE-9252868508.smiles |
| Standard InChI | MCULE-9252868508.inchi |
| InChIKey | MCULE-9252868508.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869132377 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888643085 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-872838433 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-875864956 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-869142849 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-888647505 | TargetMol | Screening Compounds - stock amount | 95 | Main component | unavailable |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 1209.326 |
| logP | 12.728 |
| H-bond acceptors | 22 |
| H-bond donors | 10 |
| Rotatable bonds | 28 |
| PSA | 314.66 |
| RO5 violations | 4 |
| RO3 violations | 6 |
| Refractivity | 312.348 |
| Atoms | 152 |
| Rings | 8 |
| Heavy atoms | 84 |
| Hydrogen atoms | 68 |
| Heteroatoms | 24 |
| N/O atoms | 18 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
