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MCULE-4062156547
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.
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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.
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|
|---|---|---|---|---|
| 1 mg | 327 USD | N/A | 10 working days | Get Quote |
| 5 mg | 327 USD | N/A | 10 working days | Get Quote |
| 10 mg | 327 USD | N/A | 10 working days | Get Quote |
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MCULE-5888202376
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4062156547.sdf |
| SMILES | MCULE-4062156547.smiles |
| Standard InChI | MCULE-4062156547.inchi |
| InChIKey | MCULE-4062156547.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-890181444 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-869236637 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-872726135 | Apexbio Technology | Bioactive Compound Library | 98 | As a main component | in stock |
| P-584619525 | MedKoo | In stock compounds | 95 | As a main component | in stock |
| P-888640834 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869127933 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 598.114 |
| logP | 7.5473 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 11 |
| PSA | 142.72 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 157.2894 |
| Atoms | 65 |
| Rings | 5 |
| Heavy atoms | 40 |
| Hydrogen atoms | 25 |
| Heteroatoms | 12 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
