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UNKNOWN STEREO
MCULE-1909586706-0
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 | 9 USD | 98 | 20 working days | Get Quote |
| 5 mg | 11 USD | 98 | 22 working days | Get Quote |
| 10 mg | 11 USD | 98 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1909586706-0.sdf |
| SMILES | MCULE-1909586706-0.smiles |
| Standard InChI | MCULE-1909586706-0.inchi |
| InChIKey | MCULE-1909586706-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867534581 | 98 | As is | in stock |
| P-875688697 | 98 | As is | in stock |
| P-595215904 | 98 | As is | by resynthesis (? - ? days) |
| P-1270365052 | 98 | As is | in stock |
| P-606839208 | N/A | As is | in stock |
| P-596935773 | 98 | As is | 20 g |
| P-864125605 | 95 | As is | in stock |
| P-893219187 | 95 | As is | in stock |
| P-860799455 | 98 | As is | in stock |
| P-675214136 | 95 | As is | in stock |
| P-869156888 | 95 | As is | 1.2 g |
| P-892293640 | 95 | As is | 1.2 g |
| P-888653088 | 95 | As is | 1.2 g |
| P-1271672525 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 424.938 |
| logP | 3.1726 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 6 |
| PSA | 104.45 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 111.2524 |
| Atoms | 53 |
| Rings | 3 |
| Heavy atoms | 28 |
| Hydrogen atoms | 25 |
| Heteroatoms | 7 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 5 |
| R/S chiral centers | 5 |
| 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 |
