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MCULE-9391954612
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 | 45 USD | 90 | 23 working days | Get Quote |
| 5 mg | 64 USD | 90 | 22 working days | Get Quote |
| 10 mg | 85 USD | 90 | 22 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-9391954612.sdf |
| SMILES | MCULE-9391954612.smiles |
| Standard InChI | MCULE-9391954612.inchi |
| InChIKey | MCULE-9391954612.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886229482 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-7497952 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 25 mg |
| P-5154993 | ChemDiv | Discovery Chemistry Library | 90 | As is | 46 mg |
| P-502806590 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-14410466 | Life Chemicals | Screening Compounds | 90 | As is | 31 mg |
| P-13015875 | Otava | In-House Stock Library | 90 | As is | 57 mg |
| P-33910611 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 367.416 |
| logP | 3.763 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 52.65 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 109.7177 |
| Atoms | 49 |
| Rings | 4 |
| Heavy atoms | 27 |
| Hydrogen atoms | 22 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
