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UNKNOWN STEREO
MCULE-2446846552
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 | 17 USD | 95 | 18 working days | Get Quote |
| 5 mg | 17 USD | 95 | 18 working days | Get Quote |
| 10 mg | 17 USD | 95 | 18 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2446846552.sdf |
| SMILES | MCULE-2446846552.smiles |
| Standard InChI | MCULE-2446846552.inchi |
| InChIKey | MCULE-2446846552.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-885967394 | N/A | As is | by synthesis |
| P-1265046060 | 90 | As is | by synthesis |
| P-1275179115 | 98 | As is | in stock |
| P-1275144308 | 95 | As is | in stock |
| P-580450516 | 98 | As is | in stock |
| P-505495043 | 95 | As is | in stock |
| P-890850974 | 90 | As is | in stock |
| P-583851071 | 92 | As is | in stock |
| P-524442108 | 97 | As is | 424 mg |
| P-881187607 | 90 | As is | 80 mg |
| P-869108402 | 95 | As is | 1.761 g |
| P-892286965 | 95 | As is | 1.761 g |
| P-888627380 | 95 | As is | 1.761 g |
| P-611517699 | 90 | As is | in stock |
| P-611517891 | 90 | As is | in stock |
| P-611442022 | 90 | As is | in stock |
| P-893946095 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 705.629 |
| logP | 5.7073 |
| H-bond acceptors | 12 |
| H-bond donors | 0 |
| Rotatable bonds | 11 |
| PSA | 104.7 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 194.534 |
| Atoms | 87 |
| Rings | 7 |
| Heavy atoms | 49 |
| Hydrogen atoms | 38 |
| Heteroatoms | 14 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 3 |
| R/S chiral centers | 2 |
| 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 |
