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MCULE-1654167903
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 | 59 USD | 98 | 16 working days | Get Quote |
| 5 mg | 237 USD | 98 | 16 working days | Get Quote |
| 10 mg | 413 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1654167903.sdf |
| SMILES | MCULE-1654167903.smiles |
| Standard InChI | MCULE-1654167903.inchi |
| InChIKey | MCULE-1654167903.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867648692 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875816348 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-613847456 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-888654026 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869158146 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 459.296 |
| logP | 5.372 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 7 |
| PSA | 93.8 |
| RO5 violations | 1 |
| RO3 violations | 6 |
| Refractivity | 117.2404 |
| Atoms | 48 |
| Rings | 4 |
| Heavy atoms | 31 |
| Hydrogen atoms | 17 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
