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UNKNOWN STEREO
MCULE-1871767131
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 | 20 USD | 98 | 20 working days | Get Quote |
| 5 mg | 20 USD | 98 | 20 working days | Get Quote |
| 10 mg | 30 USD | 98 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1871767131.sdf |
| SMILES | MCULE-1871767131.smiles |
| Standard InChI | MCULE-1871767131.inchi |
| InChIKey | MCULE-1871767131.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867551950 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875710278 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-869329500 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-606831916 | AmBeed | In stock | N/A | As is | in stock |
| P-596941890 | Angene | Building Blocks in stock | 98 | As is | 314 mg |
| P-864173716 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-868544995 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
| P-860799819 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-868078635 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-888649098 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869146987 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-855066227 | Toronto Research | In stock | 90 | As is | in stock |
| P-886926318 | eNovation Chemicals LLC | Building Block on demand | 98 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 316.780 |
| logP | 3.729 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 58.2 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 86.3579 |
| Atoms | 39 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 17 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
