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MCULE-1232748587
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 | 34 USD | 98 | 22 working days | Get Quote |
| 5 mg | 34 USD | 98 | 22 working days | Get Quote |
| 10 mg | 34 USD | 98 | 22 working days | Get Quote |
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MCULE-5205816732
- Component type: Main
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MCULE-1473847819
- Component type: Main
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MCULE-4988038426
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1232748587.sdf |
| SMILES | MCULE-1232748587.smiles |
| Standard InChI | MCULE-1232748587.inchi |
| InChIKey | MCULE-1232748587.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-888621569 | Key Organics | Building Blocks | 95 | As a main component | 500 mg |
| P-31249272 | LaboTest | Screening Collection | 90 | As a main component | unavailable |
| P-888173763 | Molnova | On demand | 98 | As a main component | by synthesis |
| P-869124812 | TargetMol | Screening Compounds - synthesis | 95 | As a main component | by synthesis |
| P-892290509 | TargetMol | In Stock BB | 95 | As a main component | 999 mg |
| P-888638516 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | 999 mg |
| P-596713077 | TimTec | ActiMol 1 Week - Stock | 90 | As a main component | 19 mg |
| P-22452671 | TimTec | ActiMol 1 Week - Stock | 90 | As a main component | 47 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 224.281 |
| logP | 3.1443 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 55.92 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 73.8538 |
| Atoms | 31 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 14 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
