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MCULE-3241914951
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 | 45 USD | 90 | 23 working days | Get Quote |
| 5 mg | 73 USD | 90 | 23 working days | Get Quote |
| 10 mg | 87 USD | 90 | 23 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-6153545744
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3241914951.sdf |
| SMILES | MCULE-3241914951.smiles |
| Standard InChI | MCULE-3241914951.inchi |
| InChIKey | MCULE-3241914951.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596493234 | Asinex | General bb catalog | 90 | As is | unavailable |
| P-621664203 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-892451223 | Asinex | General screening catalog | 90 | As a main component | 1 mg |
| P-26507788 | Otava | In-House Stock Library | 90 | As a main component | 366 mg |
| P-617698492 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As a main component | 366 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 231.293 |
| logP | 2.5413 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 47.04 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 69.1567 |
| Atoms | 34 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 17 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
