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MCULE-9232789798
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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 49 USD | 90 | 19 working days | Get Quote |
| 10 mg | 63 USD | 90 | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9232789798.sdf |
| SMILES | MCULE-9232789798.smiles |
| Standard InChI | MCULE-9232789798.inchi |
| InChIKey | MCULE-9232789798.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892973662 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-619836497 | ChemDiv | Discovery Chemistry Library | 90 | As is | 15 mg |
| P-34575044 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580769523 | Crea-Chim | Prepacked BB compounds with prompt delivery | 90 | As is | in stock |
| P-580780444 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-862086435 | FluoroChem | General BB | N/A | As is | in stock |
| P-23882837 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491134159 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-33468311 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502345803 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-1235559 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 169 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 288.723 |
| logP | 4.0168 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 46.53 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 79.1008 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
