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MCULE-1196312885-1
Structure
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- InChIKey:
- SMILES:
- InChI:
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| 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.
|
|
|---|---|---|---|---|
| 1 mg | 70 USD | 90 | 22 working days | Get Quote |
| 5 mg | 85 USD | 90 | 17 working days | Get Quote |
| 10 mg | 121 USD | 90 | 17 working days | Get Quote |
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MCULE-5748273826-1
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1196312885-1.sdf |
| SMILES | MCULE-1196312885-1.smiles |
| Standard InChI | MCULE-1196312885-1.inchi |
| InChIKey | MCULE-1196312885-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893030251 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-23352609 | Specs | Screening Compounds | 90 | As is | 4.2 g |
| P-892485143 | Asinex | General screening catalog | 90 | As a main component | unavailable |
| P-616235761 | ChemBridge | EXPRESS-Pick Collection | 90 | As a main component | 25 mg |
| P-675338136 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
| P-35248103 | Maybridge | Screening Collection | 90 | As a main component | 2.028 kg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 239.310 |
| logP | 1.8238 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 50.72 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 67.4245 |
| Atoms | 38 |
| Rings | 1 |
| Heavy atoms | 17 |
| Hydrogen atoms | 21 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
