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MCULE-4522488137
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 | 13 USD | 98 | 11 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4522488137.sdf |
| SMILES | MCULE-4522488137.smiles |
| Standard InChI | MCULE-4522488137.inchi |
| InChIKey | MCULE-4522488137.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-452649103 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-887205868 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-579477767 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-854692940 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-888171676 | Molnova | On demand | 98 | As is | by synthesis |
| P-617405012 | Selleckchem | Product Catalog | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 504.697 |
| logP | 4.0035 |
| H-bond acceptors | 6 |
| H-bond donors | 5 |
| Rotatable bonds | 2 |
| PSA | 118.22 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 140.399 |
| Atoms | 84 |
| Rings | 5 |
| Heavy atoms | 36 |
| Hydrogen atoms | 48 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 13 |
| R/S chiral centers | 13 |
| 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 |
