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MCULE-9161317315
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 | 35 USD | 95 | 14 working days | Get Quote |
| 5 mg | 35 USD | 95 | 14 working days | Get Quote |
| 10 mg | 41 USD | 95 | 14 working days | Get Quote |
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1
MCULE-4548605892
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9161317315.sdf |
| SMILES | MCULE-9161317315.smiles |
| Standard InChI | MCULE-9161317315.inchi |
| InChIKey | MCULE-9161317315.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-617324257 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-584607414 | Alinda | Building Blocks | 95 | As is | 10 g |
| P-617653148 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-861342714 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-852572288 | Matrix Scientific | All | N/A | As is | in stock |
| P-873228380 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888594623 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 182.192 |
| logP | -0.219 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 60.36 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 41.5613 |
| Atoms | 27 |
| Rings | 0 |
| Heavy atoms | 12 |
| Hydrogen atoms | 15 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 1 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
