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UNKNOWN STEREO
MCULE-7742894838
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 | 23 working days | Get Quote |
| 5 mg | 54 USD | 90 | 23 working days | Get Quote |
| 10 mg | 68 USD | 90 | 23 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-7742894838.sdf |
| SMILES | MCULE-7742894838.smiles |
| Standard InChI | MCULE-7742894838.inchi |
| InChIKey | MCULE-7742894838.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-577213742 | ChemDiv | Discovery Chemistry Library | 90 | As is | 12 mg |
| P-428628002 | Eximed | In-stock screening compounds | 90 | As is | 2.225 g |
| P-492273003 | Eximed | Building Block Catalog | 95 | As is | 2.225 g |
| P-580005638 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-580041188 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-488545148 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-24487494 | InterBioScreen | Natural Compounds | 92 | As is | 300 mg |
| P-674817344 | Otava | In-House Stock Library | 90 | As is | 2.225 g |
| P-620218985 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 2.225 g |
| P-454365389 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-445349585 | Pharmeks LLC | Semi-natural compounds | 92 | As is | 300 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 230.304 |
| logP | 2.0635 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 67.43 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 62.4684 |
| Atoms | 38 |
| Rings | 0 |
| Heavy atoms | 16 |
| Hydrogen atoms | 22 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
