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UNKNOWN STEREO
MCULE-4748076858
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 | 11 USD | N/A | 9 working days | Get Quote |
| 5 mg | 11 USD | N/A | 9 working days | Get Quote |
| 10 mg | 11 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-4748076858.sdf |
| SMILES | MCULE-4748076858.smiles |
| Standard InChI | MCULE-4748076858.inchi |
| InChIKey | MCULE-4748076858.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-869191251 | 95 | As is | in stock |
| P-505352072 | 98 | As is | in stock |
| P-505403874 | 99 | As is | in stock |
| P-606854833 | N/A | As is | in stock |
| P-872868187 | 100 | As is | in stock |
| P-577214051 | 90 | As is | 28 mg |
| P-580452394 | 98 | As is | in stock |
| P-428629654 | 90 | As is | in stock |
| P-864497844 | 90 | As is | in stock |
| P-864497620 | 90 | As is | in stock |
| P-904200652 | 95 | As is | 2.98 g |
| P-580041788 | 90 | As is | in stock |
| P-580005764 | 95 | As is | in stock |
| P-488555418 | 92 | As is | in stock |
| P-488544920 | 90 | As is | in stock |
| P-524443584 | 97 | As is | 265 mg |
| P-674817427 | 90 | As is | 2.98 g |
| P-620219070 | 95 | As is | 2.98 g |
| P-454364324 | 92 | As is | in stock |
| P-445305692 | 92 | As is | 300 mg |
| P-500375703 | 98 | As is | by synthesis |
| P-869120820 | 95 | As is | by synthesis |
| P-892289583 | 95 | As is | 1.004 g |
| P-888635564 | 95 | As is | 1.004 g |
| P-854957712 | 90 | As is | in stock |
| P-464689803 | 90 | As is | 1.014 g |
| P-2071931 | 90 | As is | 1.014 g |
| P-480195680 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 317.422 |
| logP | 3.6518 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 66.4 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 91.7515 |
| Atoms | 50 |
| Rings | 2 |
| Heavy atoms | 23 |
| Hydrogen atoms | 27 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
