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UNKNOWN STEREO
MCULE-9566909451
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 | 39 USD | 95 | 9 working days | Get Quote |
| 5 mg | 39 USD | 95 | 9 working days | Get Quote |
| 10 mg | 39 USD | 95 | 9 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-9566909451.sdf |
| SMILES | MCULE-9566909451.smiles |
| Standard InChI | MCULE-9566909451.inchi |
| InChIKey | MCULE-9566909451.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875809693 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-851940743 | AmBeed | In stock | N/A | As is | in stock |
| P-888820051 | Angene | Building Blocks in stock | 98 | As is | 50 g |
| P-864181406 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893232153 | Biosynth | In Stock | 95 | As is | in stock |
| P-13987998 | InterBioScreen | Natural Compounds | 92 | As is | 173 mg |
| P-642495793 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-594274502 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892295998 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888656912 | TargetMol | Screening Compounds - stock amount | 95 | As is | 203 mg |
| P-611382434 | Toronto Research | In stock | 90 | As is | in stock |
| P-886909992 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 361.393 |
| logP | 3.3947 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 7 |
| PSA | 97.98 |
| RO5 violations | 0 |
| RO3 violations | 6 |
| Refractivity | 103.6099 |
| Atoms | 46 |
| Rings | 4 |
| Heavy atoms | 27 |
| Hydrogen atoms | 19 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
