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MCULE-4749930502-1
Structure
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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 | 245 USD | 98 | 20 working days | Get Quote |
| 10 mg | 260 USD | N/A | 14 working days | Get Quote |
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MCULE-7857840565-1
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4749930502-1.sdf |
| SMILES | MCULE-4749930502-1.smiles |
| Standard InChI | MCULE-4749930502-1.inchi |
| InChIKey | MCULE-4749930502-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-851857205 | AmBeed | On request | N/A | As is | by synthesis |
| P-873289842 | Angene | Building Blocks in stock | 98 | As is | 10 mg |
| P-591015951 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-870652924 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-868078918 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-896084253 | Specs | Repurposed Compounds | N/A | As is | 595 mg |
| P-869121212 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888635889 | TargetMol | Screening Compounds - stock amount | 95 | As is | 13 mg |
| P-872753084 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-608495286 | DC Chemicals Limited | Stock Products | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 241.248 |
| logP | -0.843 |
| H-bond acceptors | 8 |
| H-bond donors | 6 |
| Rotatable bonds | 2 |
| PSA | 136.29 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 68.3741 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 15 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 3 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
