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MCULE-4538645287
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 | 89 USD | 90 | 12 working days | Get Quote |
| 5 mg | 97 USD | 90 | 12 working days | Get Quote |
| 10 mg | 130 USD | 92 | 16 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-3654166896
- Component type: Main
-
1
MCULE-1504889908
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4538645287.sdf |
| SMILES | MCULE-4538645287.smiles |
| Standard InChI | MCULE-4538645287.inchi |
| InChIKey | MCULE-4538645287.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-13239007 | Pharmeks LLC | Natural & unique compounds | 92 | As is | 300 mg |
| P-425203615 | Alinda | Stock Screening Compounds | 90 | Main component | in stock |
| P-675188499 | AnalytiCon Discovery | Natural screening compounds (70%+) | 70 | Main component | 46 mg |
| P-869402605 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-448676645 | ChemDiv | Discovery Chemistry Library | 90 | Main component | 141 mg |
| P-873243382 | Key Organics | Building Blocks | 97 | Main component | 5 mg |
| P-888172759 | Molnova | On demand | 98 | Main component | by synthesis |
| P-888663902 | TargetMol | Screening Compounds | 95 | Main component | by synthesis |
| P-869172570 | TargetMol | Screening Compounds - stock amount | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 395.428 |
| logP | 2.8556 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 137.95 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 100.8156 |
| Atoms | 48 |
| Rings | 4 |
| Heavy atoms | 27 |
| Hydrogen atoms | 21 |
| Heteroatoms | 9 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
