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MCULE-1113442860
Compound
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- InChI:
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| 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 | 95 | 19 working days | Get Quote |
| 10 mg | 73 USD | 95 | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1113442860.sdf |
| SMILES | MCULE-1113442860.smiles |
| Standard InChI | MCULE-1113442860.inchi |
| InChIKey | MCULE-1113442860.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869263073 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-502605668 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-12506577 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-18840757 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 612.144 |
| logP | 6.8794 |
| H-bond acceptors | 8 |
| H-bond donors | 1 |
| Rotatable bonds | 9 |
| PSA | 167.5 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 165.1228 |
| Atoms | 62 |
| Rings | 5 |
| Heavy atoms | 40 |
| Hydrogen atoms | 22 |
| Heteroatoms | 12 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
