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MCULE-4085365421
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 | 15 USD | 98 | 8 working days | Get Quote |
| 5 mg | 15 USD | 98 | 8 working days | Get Quote |
| 10 mg | 15 USD | 98 | 8 working days | Get Quote |
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1
MCULE-9743143399
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4085365421.sdf |
| SMILES | MCULE-4085365421.smiles |
| Standard InChI | MCULE-4085365421.inchi |
| InChIKey | MCULE-4085365421.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903078115 | 98 | As is | 50 g |
| P-580699897 | 98 | As is | 54.95 g |
| P-871220274 | N/A | As is | by resynthesis (? - ? days) |
| P-505575099 | 98 | As is | in stock |
| P-851246044 | 95 | As is | by synthesis |
| P-870584812 | 97 | As is | in stock |
| P-852487558 | N/A | As is | in stock |
| P-896627360 | 95 | As is | by synthesis |
| P-854719440 | 95 | As is | in stock |
| P-474025075 | 95 | As is | in stock |
| P-608272231 | 98 | As is | in stock |
| P-903130855 | 99 | Main component | 10 g |
| P-619605621 | 99 | Main component | 12.6 g |
| P-851319417 | 95 | Main component | by synthesis |
| P-901647365 | 98 | Main component | in stock |
| P-579626234 | 95 | Main component | 50 g |
| P-896627932 | 95 | Main component | by synthesis |
| P-895182250 | 95 | Main component | in stock |
| P-871072019 | 95 | Main component | in stock |
| P-608272437 | 98 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 608.164 |
| logP | 7.6133 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 12 |
| PSA | 98.55 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 170.7033 |
| Atoms | 77 |
| Rings | 5 |
| Heavy atoms | 42 |
| Hydrogen atoms | 35 |
| Heteroatoms | 7 |
| N/O atoms | 4 |
| Inorganic atoms | 1 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
