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MCULE-8649603287
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 | 79 USD | 90 | 22 working days | Get Quote |
| 5 mg | 114 USD | 90 | 22 working days | Get Quote |
| 10 mg | 135 USD | 90 | 18 working days | Get Quote |
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1
MCULE-1271327975
- Component type: Main
-
2
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8649603287.sdf |
| SMILES | MCULE-8649603287.smiles |
| Standard InChI | MCULE-8649603287.inchi |
| InChIKey | MCULE-8649603287.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-885961897 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-894673106 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-4362041 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 20 mg |
| P-675338139 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-25738913 | Life Chemicals | Screening Compounds | 90 | As is | 809 mg |
| P-885963225 | A2B Chem | Predominantly Building Block on demand | 95 | Main component | by synthesis |
| P-874644823 | AK Scientific | Building Blocks | 97 | Main component | in stock |
| P-502532253 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-892483512 | Asinex | General screening catalog | 90 | Main component as a main component | 3 mg |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 415.350 |
| logP | 3.864 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 7 |
| PSA | 45.17 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 119.9128 |
| Atoms | 55 |
| Rings | 3 |
| Heavy atoms | 27 |
| Hydrogen atoms | 28 |
| Heteroatoms | 7 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
