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MCULE-2896575114
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 | 21 working days | Get Quote |
| 5 mg | 72 USD | 90 | 21 working days | Get Quote |
| 10 mg | 86 USD | 90 | 21 working days | Get Quote |
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1
MCULE-1756572785
- Component type: Main
-
1
MCULE-4094049864
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2896575114.sdf |
| SMILES | MCULE-2896575114.smiles |
| Standard InChI | MCULE-2896575114.inchi |
| InChIKey | MCULE-2896575114.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-31176361 | LaboTest | Screening Collection | 90 | As is | 100 mg |
| P-596275043 | Asinex | General screening catalog | 90 | Main component | unavailable |
| P-4608769 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component | 10 mg |
| P-502887069 | Innovapharm | Screening Compounds | 90 | Main component | in stock |
| P-31142600 | LaboTest | Screening Collection | 90 | Main component | 250 mg |
| P-881177577 | Otava | In-House Stock Library | 90 | Main component | 50 mg |
| P-491348705 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 344.365 |
| logP | 3.166 |
| H-bond acceptors | 8 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 123.83 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 101.8244 |
| Atoms | 45 |
| Rings | 3 |
| Heavy atoms | 25 |
| Hydrogen atoms | 20 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
