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MCULE-4825978641
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 | 54 USD | 97 | 20 working days | Get Quote |
| 5 mg | 54 USD | 97 | 20 working days | Get Quote |
| 10 mg | 54 USD | 97 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4825978641.sdf |
| SMILES | MCULE-4825978641.smiles |
| Standard InChI | MCULE-4825978641.inchi |
| InChIKey | MCULE-4825978641.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867595821 | 95 | As is | in stock |
| P-893447512 | 90 | As is | 1.75 g |
| P-1270318528 | 97 | As is | in stock |
| P-851693165 | N/A | As is | by synthesis |
| P-881089971 | 97 | As is | 1.75 g |
| P-864155407 | 95 | As is | in stock |
| P-591079169 | 97 | As is | by synthesis |
| P-887328779 | 95 | As is | by synthesis |
| P-580279764 | 95 | As is | by resynthesis (? - ? days) |
| P-889405022 | 97 | As is | 1.75 g |
| P-608106471 | 95 | As is | in stock |
| P-854937075 | 95 | As is | by synthesis |
| P-896076949 | N/A | As is | 3.166 g |
| P-502403161 | 90 | As is | in stock |
| P-611379804 | 90 | As is | in stock |
| P-1271724296 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 225.249 |
| logP | 2.038 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 69.62 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 65.4764 |
| Atoms | 28 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 11 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
