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UNKNOWN STEREO
MCULE-4625269332
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 | 43 USD | 95 | 7 working days | Get Quote |
| 5 mg | 71 USD | 95 | 7 working days | Get Quote |
| 10 mg | 108 USD | 95 | 7 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-4324317094
- Component type: Main
-
1
MCULE-6124492894
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4625269332.sdf |
| SMILES | MCULE-4625269332.smiles |
| Standard InChI | MCULE-4625269332.inchi |
| InChIKey | MCULE-4625269332.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-901461082 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-872785255 | Chemtos | Products on-demand | 95 | As is | by synthesis |
| P-869126643 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892290999 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888639974 | TargetMol | Screening Compounds - stock amount | 95 | As is | 151 mg |
| P-855020956 | Toronto Research | In stock | 90 | As is | in stock |
| P-855020958 | Toronto Research | In stock | 90 | As is | in stock |
| P-892251672 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-892336844 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | unavailable |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 436.338 |
| logP | -1.3672 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 66.76 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 111.1928 |
| Atoms | 53 |
| Rings | 6 |
| Heavy atoms | 27 |
| Hydrogen atoms | 26 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 5 |
| R/S chiral centers | 4 |
| 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 |
