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UNKNOWN STEREO
MCULE-6547430558
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 | 44 USD | 95 | 7 working days | Get Quote |
| 5 mg | 103 USD | 95 | 7 working days | Get Quote |
| 10 mg | 172 USD | 95 | 7 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-6547430558.sdf |
| SMILES | MCULE-6547430558.smiles |
| Standard InChI | MCULE-6547430558.inchi |
| InChIKey | MCULE-6547430558.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875851794 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-505353987 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-873299348 | Angene | Building Blocks in stock | 98 | As is | 500 mg |
| P-889585789 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-524444476 | Key Organics | Biochemicals | 97 | As is | unavailable |
| P-892274974 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-869178624 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892299608 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-892351321 | TargetMol | Screening Compounds - stock amount | 95 | As is | 43 mg |
| P-481010385 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 578.651 |
| logP | 4.1004 |
| H-bond acceptors | 10 |
| H-bond donors | 1 |
| Rotatable bonds | 9 |
| PSA | 108.55 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 159.0302 |
| Atoms | 80 |
| Rings | 6 |
| Heavy atoms | 42 |
| Hydrogen atoms | 38 |
| Heteroatoms | 10 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 6 |
| R/S chiral centers | 6 |
| 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 |
