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MCULE-7169523127-0
Structure
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- InChI:
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| 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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 49 USD | 90 | 19 working days | Get Quote |
| 10 mg | 63 USD | 90 | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-7169523127-0.sdf |
| SMILES | MCULE-7169523127-0.smiles |
| Standard InChI | MCULE-7169523127-0.inchi |
| InChIKey | MCULE-7169523127-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867418338 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-500418283 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-608221007 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-596587492 | Key Organics | Building Blocks | 90 | As is | 500 mg |
| P-893203638 | Otava | In-House Stock Library | 90 | As is | 600 mg |
| P-868120643 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 8.165 g |
| P-23969064 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-3226668 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 647 mg |
| P-1885918 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 647 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 435.518 |
| logP | 4.1617 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 11 |
| PSA | 112.07 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 122.9535 |
| Atoms | 61 |
| Rings | 3 |
| Heavy atoms | 32 |
| Hydrogen atoms | 29 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
