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MCULE-9123640981
Compound
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- InChIKey:
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- 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 | 44 USD | 90 | 21 working days | Get Quote |
| 5 mg | 71 USD | 90 | 21 working days | Get Quote |
| 10 mg | 85 USD | 90 | 21 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-9123640981.sdf |
| SMILES | MCULE-9123640981.smiles |
| Standard InChI | MCULE-9123640981.inchi |
| InChIKey | MCULE-9123640981.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596493104 | Asinex | General bb catalog | 90 | As is | 47 mg |
| P-596417529 | Asinex | General screening catalog | 90 | As is | 47 mg |
| P-4244666 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-855920643 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
| P-596570217 | Key Organics | Building Blocks | 97 | As is | 5 g |
| P-856006756 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-620223371 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-620068326 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-885542645 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-888226523 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 7 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 260.288 |
| logP | 1.779 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 71.19 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 71.5864 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
