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MCULE-2216718310
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 | 90 USD | 97 | 14 working days | Get Quote |
| 5 mg | 174 USD | 97 | 14 working days | Get Quote |
| 10 mg | 310 USD | 98 | 16 working days | Get Quote |
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MCULE-7432152803
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2216718310.sdf |
| SMILES | MCULE-2216718310.smiles |
| Standard InChI | MCULE-2216718310.inchi |
| InChIKey | MCULE-2216718310.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903344965 | 97 | As is | 15 mg |
| P-893617734 | 90 | As is | 28.862 g |
| P-1275104284 | N/A | As is | by resynthesis (? - ? days) |
| P-878642332 | 98 | As is | in stock |
| P-871067169 | 95 | As a main component | in stock |
| P-878643368 | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 1480.610 |
| logP | 5.0498 |
| H-bond acceptors | 33 |
| H-bond donors | 6 |
| Rotatable bonds | 54 |
| PSA | 410.53 |
| RO5 violations | 4 |
| RO3 violations | 6 |
| Refractivity | 383.1032 |
| Atoms | 203 |
| Rings | 9 |
| Heavy atoms | 106 |
| Hydrogen atoms | 97 |
| Heteroatoms | 33 |
| N/O atoms | 33 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 2 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
