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MCULE-9116773575
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 | 13 USD | 98 | 9 working days | Get Quote |
| 5 mg | 13 USD | 98 | 9 working days | Get Quote |
| 10 mg | 13 USD | 98 | 9 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9116773575.sdf |
| SMILES | MCULE-9116773575.smiles |
| Standard InChI | MCULE-9116773575.inchi |
| InChIKey | MCULE-9116773575.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-610891038 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
| P-500414570 | AvaChem Scientific | All products | 99 | As is | by synthesis |
| P-580713468 | BLD pharm | In-stock building blocks | 98 | As is | 246.55 g |
| P-871220089 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-505573002 | Bosche Scientific | Bosche Products | 98 | As is | in stock |
| P-881633793 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-866711387 | Chemshuttle | Stock catalog | 95 | As is | 15 g |
| P-579480788 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-862056849 | FluoroChem | General BB | N/A | As is | in stock |
| P-854718321 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-579709959 | Selleckchem | Product Catalog | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 720.948 |
| logP | 7.0779 |
| H-bond acceptors | 11 |
| H-bond donors | 4 |
| Rotatable bonds | 22 |
| PSA | 202.26 |
| RO5 violations | 3 |
| RO3 violations | 6 |
| Refractivity | 197.8239 |
| Atoms | 98 |
| Rings | 4 |
| Heavy atoms | 50 |
| Hydrogen atoms | 48 |
| Heteroatoms | 13 |
| N/O atoms | 11 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
