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MCULE-2799068861-1
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 | 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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| Name | File |
|---|---|
| SDF | MCULE-2799068861-1.sdf |
| SMILES | MCULE-2799068861-1.smiles |
| Standard InChI | MCULE-2799068861-1.inchi |
| InChIKey | MCULE-2799068861-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-851882412 | AmBeed | On request | N/A | As is | by synthesis |
| P-866723580 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-889801460 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-591180389 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-427945821 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-454667062 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-862074515 | FluoroChem | General BB | N/A | As is | in stock |
| P-492236353 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502508543 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503084848 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-502612555 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-35283079 | Maybridge | Screening Collection | 90 | As is | 3.177 kg |
| P-13129275 | Otava | In-House Stock Library | 90 | As is | 47 mg |
| P-12518226 | Specs | Screening Compounds | 90 | As is | 18 mg |
| P-33454736 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-873235174 | TimTec | Building Block Collection | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 234.302 |
| logP | 2.7131 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 102.23 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 63.5537 |
| Atoms | 21 |
| Rings | 3 |
| Heavy atoms | 15 |
| Hydrogen atoms | 6 |
| Heteroatoms | 5 |
| 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 |
