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MCULE-8246031929
Compound
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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 | 91 USD | N/A | 14 working days | Get Quote |
| 5 mg | 191 USD | N/A | 14 working days | Get Quote |
| 10 mg | 249 USD | N/A | 14 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-8246031929.sdf |
| SMILES | MCULE-8246031929.smiles |
| Standard InChI | MCULE-8246031929.inchi |
| InChIKey | MCULE-8246031929.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-889751682 | AmBeed | In stock | N/A | As is | in stock |
| P-489245415 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-889521077 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-871216474 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-887183177 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-867943519 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 741.454 |
| logP | 8.8225 |
| H-bond acceptors | 10 |
| H-bond donors | 3 |
| Rotatable bonds | 9 |
| PSA | 200.67 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 163.1839 |
| Atoms | 60 |
| Rings | 5 |
| Heavy atoms | 41 |
| Hydrogen atoms | 19 |
| Heteroatoms | 15 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
