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MCULE-5182307063-0
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 | 50 USD | 90 | 19 working days | Get Quote |
| 5 mg | 64 USD | 98 | 22 working days | Get Quote |
| 10 mg | 91 USD | 90 | 19 working days | Get Quote |
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1
MCULE-6113365342-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5182307063-0.sdf |
| SMILES | MCULE-5182307063-0.smiles |
| Standard InChI | MCULE-5182307063-0.inchi |
| InChIKey | MCULE-5182307063-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596584354 | Key Organics | Building Blocks | 97 | As is | 100 mg |
| P-855928485 | Key Organics | Building Blocks | 95 | As is | 1 mg |
| P-888173870 | Molnova | On demand | 98 | As is | by synthesis |
| P-19098093 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-22896067 | TimTec | ActiMol 3 Week | 90 | Main component | in stock |
| P-825200 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 1.675 g |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 462.878 |
| logP | 1.9581 |
| H-bond acceptors | 9 |
| H-bond donors | 5 |
| Rotatable bonds | 2 |
| PSA | 161.39 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 117.6145 |
| Atoms | 55 |
| Rings | 4 |
| Heavy atoms | 32 |
| Hydrogen atoms | 23 |
| Heteroatoms | 10 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
