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UNKNOWN STEREO
MCULE-1906242559
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 | 139 USD | 98 | 20 working days | Get Quote |
| 5 mg | 333 USD | N/A | 35 working days | Get Quote |
| 10 mg | 623 USD | 90 | 16 working days | Get Quote |
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1
MCULE-8596796980
- Component type: Main
-
2
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1906242559.sdf |
| SMILES | MCULE-1906242559.smiles |
| Standard InChI | MCULE-1906242559.inchi |
| InChIKey | MCULE-1906242559.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-874652992 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-867616788 | A2B Chem | Predominantly Building Block in stock | 90 | Main component | in stock |
| P-875777640 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-869211443 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851711001 | AmBeed | On request | N/A | Main component | by synthesis |
| P-881096195 | Angene | Building Blocks in stock | 98 | Main component | 2 mg |
| P-881651979 | Apexbio Technology | Bioactive Compound Library | 98 | Main component | in stock |
| P-864262819 | AstaTech | Backordered BBs | 98 | Main component | by synthesis |
| P-888627627 | TargetMol | Screening Compounds | 95 | Main component | by synthesis |
| P-869108784 | TargetMol | Screening Compounds - stock amount | 95 | Main component | in stock |
| P-868534522 | eNovation Chemicals LLC | Building Blocks in stock | 98 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 359.097 |
| logP | 2.5298 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 9 |
| PSA | 107.02 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 96.8838 |
| Atoms | 51 |
| Rings | 1 |
| Heavy atoms | 22 |
| Hydrogen atoms | 29 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
