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MCULE-2559027376
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 | 22 USD | 95 | 8 working days | Get Quote |
| 5 mg | 22 USD | 95 | 8 working days | Get Quote |
| 10 mg | 22 USD | 95 | 8 working days | Get Quote |
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MCULE-5001416170
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2559027376.sdf |
| SMILES | MCULE-2559027376.smiles |
| Standard InChI | MCULE-2559027376.inchi |
| InChIKey | MCULE-2559027376.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903204356 | 95 | As is | 50 g |
| P-580703400 | 95 | As is | 31.35 g |
| P-851266789 | 95 | As is | by synthesis |
| P-868628778 | 97 | As is | in stock |
| P-862047119 | 95 | As is | 1.16 g |
| P-905348567 | 95 | As is | 500 mg |
| P-1275019041 | 95 | As is | in stock |
| P-1272593738 | 95 | As is | 5 g |
| P-852494950 | 95 | As is | by synthesis |
| P-888855707 | N/A | As is | in stock |
| P-906821528 | 98 | As is | by synthesis |
| P-895304094 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 335.446 |
| logP | 3.2426 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 48.05 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 106.1217 |
| Atoms | 50 |
| Rings | 4 |
| Heavy atoms | 25 |
| Hydrogen atoms | 25 |
| 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 |
