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MCULE-9913176697
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 | 125 USD | 98 | 8 working days | Get Quote |
| 5 mg | 125 USD | 98 | 8 working days | Get Quote |
| 10 mg | 125 USD | 98 | 8 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9913176697.sdf |
| SMILES | MCULE-9913176697.smiles |
| Standard InChI | MCULE-9913176697.inchi |
| InChIKey | MCULE-9913176697.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-608218890 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-608220306 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-855914634 | Key Organics | Building Blocks | 97 | As is | 1 mg |
| P-608117485 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-579628986 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-885544438 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596709992 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 10 mg |
| P-611390028 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 442.371 |
| logP | 2.5276 |
| H-bond acceptors | 10 |
| H-bond donors | 7 |
| Rotatable bonds | 4 |
| PSA | 177.14 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 110.0415 |
| Atoms | 50 |
| Rings | 4 |
| Heavy atoms | 32 |
| Hydrogen atoms | 18 |
| Heteroatoms | 10 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
