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UNKNOWN STEREO
MCULE-2068175809
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 | 345 USD | 98 | 37 working days | Get Quote |
| 5 mg | 345 USD | 98 | 37 working days | Get Quote |
| 10 mg | 345 USD | 98 | 37 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-1772681143
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2068175809.sdf |
| SMILES | MCULE-2068175809.smiles |
| Standard InChI | MCULE-2068175809.inchi |
| InChIKey | MCULE-2068175809.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-881652700 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-888640733 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869127766 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-854972729 | Toronto Research | In stock | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 425.559 |
| logP | 3.3255 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 62.16 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 122.6808 |
| Atoms | 66 |
| Rings | 7 |
| Heavy atoms | 31 |
| Hydrogen atoms | 35 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 6 |
| R/S chiral centers | 6 |
| 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 |
