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UNKNOWN STEREO
MCULE-2054566768
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 | 42 USD | N/A | 14 working days | Get Quote |
| 5 mg | 106 USD | N/A | 14 working days | Get Quote |
| 10 mg | 212 USD | N/A | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-2054566768.sdf |
| SMILES | MCULE-2054566768.smiles |
| Standard InChI | MCULE-2054566768.inchi |
| InChIKey | MCULE-2054566768.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867637221 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875802021 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-612940412 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-606864229 | AmBeed | In stock | N/A | As is | in stock |
| P-596967890 | Angene | Building Blocks in stock | 95 | As is | 23 mg |
| P-864173818 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-675218848 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-594273188 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-869176458 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892292981 | TargetMol | In Stock BB | 95 | As is | 250 mg |
| P-892328474 | TargetMol | Screening Compounds - stock amount | 95 | As is | 250 mg |
| P-615410200 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 498.736 |
| logP | 7.8044 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 63.6 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 146.3908 |
| Atoms | 86 |
| Rings | 5 |
| Heavy atoms | 36 |
| Hydrogen atoms | 50 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 8 |
| R/S chiral centers | 8 |
| 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 |
