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MCULE-4985519583-0
Structure
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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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 USD | 98 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4985519583-0.sdf |
| SMILES | MCULE-4985519583-0.smiles |
| Standard InChI | MCULE-4985519583-0.inchi |
| InChIKey | MCULE-4985519583-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-872937252 | 95 | As is | by synthesis |
| P-890144572 | N/A | As is | in stock |
| P-869272389 | 95 | As is | in stock |
| P-903065245 | 98 | As is | 400 g |
| P-907314776 | 95 | As is | by synthesis |
| P-489217248 | 97 | As is | in stock |
| P-489116389 | 97 | As is | in stock |
| P-596983360 | 98 | As is | 200 g |
| P-864187551 | 98 | As is | in stock |
| P-868618274 | 98 | As is | in stock |
| P-580430596 | 95 | As is | by resynthesis (? - ? days) |
| P-862122812 | 98 | As is | 34 g |
| P-870641191 | 97 | As is | 100 mg |
| P-596601889 | 97 | As is | 25 g |
| P-893278065 | 95 | As is | 500 g |
| P-31252056 | 90 | As is | unavailable |
| P-852538252 | N/A | As is | in stock |
| P-854738122 | 95 | As is | in stock |
| P-885517358 | 95 | As is | by synthesis |
| P-615404524 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 291.967 |
| logP | 3.4152 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 17.07 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 57.0135 |
| Atoms | 20 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 8 |
| Heteroatoms | 3 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| 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 |
