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MCULE-4729132331-1
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 | 37 USD | 95 | 7 working days | Get Quote |
| 5 mg | 83 USD | 95 | 7 working days | Get Quote |
| 10 mg | 134 USD | 95 | 7 working days | Get Quote |
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1
MCULE-1468555518-1
- Component type: Main
-
1
MCULE-5889111640-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4729132331-1.sdf |
| SMILES | MCULE-4729132331-1.smiles |
| Standard InChI | MCULE-4729132331-1.inchi |
| InChIKey | MCULE-4729132331-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-904223008 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-904239206 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-904320319 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 105 mg |
| P-887187210 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-869119257 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-888634194 | TargetMol | Screening Compounds - stock amount | 95 | Main component | 100 mg |
| P-489234075 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 558.627 |
| logP | 4.7038 |
| H-bond acceptors | 11 |
| H-bond donors | 4 |
| Rotatable bonds | 8 |
| PSA | 151.58 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 163.892 |
| Atoms | 75 |
| Rings | 6 |
| Heavy atoms | 41 |
| Hydrogen atoms | 34 |
| Heteroatoms | 11 |
| N/O atoms | 11 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
