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MCULE-2807119527
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 | 181 USD | 95 | 12 working days | Get Quote |
| 5 mg | 471 USD | 95 | 12 working days | Get Quote |
| 10 mg | 681 USD | 95 | 12 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2807119527.sdf |
| SMILES | MCULE-2807119527.smiles |
| Standard InChI | MCULE-2807119527.inchi |
| InChIKey | MCULE-2807119527.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892862577 | N/A | As is | in stock |
| P-890155758 | N/A | As is | in stock |
| P-893454509 | 90 | As is | 225 mg |
| P-851545679 | N/A | As is | by synthesis |
| P-895099466 | N/A | As is | 100 mg |
| P-1273260666 | 95 | As is | by resynthesis (? - ? days) |
| P-890227588 | 97 | As is | by synthesis |
| P-854707998 | 95 | As is | by synthesis |
| P-892288747 | 95 | As is | unavailable |
| P-869118152 | 95 | As is | 5.784 g |
| P-888633247 | 95 | As is | 5.784 g |
| P-1271625166 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 565.548 |
| logP | 6.9368 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 8 |
| PSA | 45.67 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 143.568 |
| Atoms | 69 |
| Rings | 4 |
| Heavy atoms | 40 |
| Hydrogen atoms | 29 |
| Heteroatoms | 11 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 6 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
