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MCULE-1845539356-0
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 | 29 USD | 99 | 14 working days | Get Quote |
| 5 mg | 45 USD | 99 | 14 working days | Get Quote |
| 10 mg | 67 USD | 99 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1845539356-0.sdf |
| SMILES | MCULE-1845539356-0.smiles |
| Standard InChI | MCULE-1845539356-0.inchi |
| InChIKey | MCULE-1845539356-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903174671 | 99 | As is | 1.25 g |
| P-610959360 | 90 | As is | 80.588 g |
| P-489188074 | 97 | As is | in stock |
| P-900154969 | 99 | As is | in stock |
| P-580703932 | 99 | As is | 3.398 g |
| P-1275105784 | N/A | As is | by resynthesis (? - ? days) |
| P-881634181 | 98 | As is | in stock |
| P-851249687 | 95 | As is | by synthesis |
| P-1272595438 | 97 | As is | 1000 mg |
| P-852503605 | 97 | As is | by synthesis |
| P-854714268 | 95 | As is | in stock |
| P-474021558 | 95 | As is | in stock |
| P-608276900 | 98 | As is | in stock |
| P-579709883 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 521.654 |
| logP | 4.0886 |
| H-bond acceptors | 10 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 102.93 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 158.8939 |
| Atoms | 77 |
| Rings | 5 |
| Heavy atoms | 38 |
| Hydrogen atoms | 39 |
| Heteroatoms | 10 |
| N/O atoms | 10 |
| 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 |
