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MCULE-1152569746
Compound
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- InChIKey:
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- 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.
|
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 | 64 USD | 90 | 22 working days | Get Quote |
| 5 mg | 94 USD | 90 | 22 working days | Get Quote |
| 10 mg | 260 USD | 90 | 9 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1152569746.sdf |
| SMILES | MCULE-1152569746.smiles |
| Standard InChI | MCULE-1152569746.inchi |
| InChIKey | MCULE-1152569746.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886502428 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-890123591 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-869452921 | Asinex | General screening catalog | 90 | As is | 1 mg |
| P-5607776 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-12464703 | Specs | Screening Compounds | 90 | As is | 126 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 294.378 |
| logP | 1.6717 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 179.22 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 66.1226 |
| Atoms | 27 |
| Rings | 1 |
| Heavy atoms | 17 |
| Hydrogen atoms | 10 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
