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UNKNOWN STEREO
MCULE-2560888045
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 | 30 USD | N/A | 9 working days | Get Quote |
| 5 mg | 30 USD | N/A | 9 working days | Get Quote |
| 10 mg | 37 USD | N/A | 9 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-2560888045.sdf |
| SMILES | MCULE-2560888045.smiles |
| Standard InChI | MCULE-2560888045.inchi |
| InChIKey | MCULE-2560888045.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867550159 | 95 | As is | in stock |
| P-875707916 | N/A | As is | in stock |
| P-611623938 | 98 | As is | in stock |
| P-869193997 | 95 | As is | in stock |
| P-606929452 | N/A | As is | in stock |
| P-596941255 | 98 | As is | 1.25 g |
| P-889542143 | 95 | As is | in stock |
| P-868545228 | 99 | As is | in stock |
| P-860799260 | 98 | As is | in stock |
| P-868078756 | 95 | As is | in stock |
| P-869161858 | 95 | As is | by synthesis |
| P-892296707 | 95 | As is | unavailable |
| P-888657243 | 95 | As is | 184 mg |
| P-886927852 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 383.444 |
| logP | 0.8381 |
| H-bond acceptors | 8 |
| H-bond donors | 3 |
| Rotatable bonds | 8 |
| PSA | 99.61 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 107.4587 |
| Atoms | 53 |
| Rings | 4 |
| Heavy atoms | 28 |
| Hydrogen atoms | 25 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
