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MCULE-8237117336
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 | 47 USD | 90 | 21 working days | Get Quote |
| 5 mg | 75 USD | 90 | 21 working days | Get Quote |
| 10 mg | 90 USD | 90 | 21 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-8237117336.sdf |
| SMILES | MCULE-8237117336.smiles |
| Standard InChI | MCULE-8237117336.inchi |
| InChIKey | MCULE-8237117336.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-4224569 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | in stock |
| P-3451446 | ChemDiv | Discovery Chemistry Library | 90 | As is | 121 mg |
| P-502759782 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-656012341 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-888759047 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-491470521 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-22474914 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 205 mg |
| P-588795321 | VITAS M CHEMICAL LIMITED | Virtual synthesis library | N/A | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 286.282 |
| logP | 3.5169 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 84.15 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 80.5557 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 21 |
| Hydrogen atoms | 14 |
| Heteroatoms | 6 |
| 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 |
