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MCULE-7020111696
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 | 77 USD | 98 | 22 working days | Get Quote |
| 5 mg | 89 USD | N/A | 9 working days | Get Quote |
| 10 mg | 110 USD | 90 | 17 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-7020111696.sdf |
| SMILES | MCULE-7020111696.smiles |
| Standard InChI | MCULE-7020111696.inchi |
| InChIKey | MCULE-7020111696.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867593119 | 98 | As is | in stock |
| P-875752026 | N/A | As is | in stock |
| P-903083661 | 98 | As is | 1000 mg |
| P-904320588 | 90 | As is | 2.109 g |
| P-904029276 | N/A | As is | by synthesis |
| P-888815390 | 98 | As is | 1000 mg |
| P-905463031 | 95 | As is | in stock |
| P-905556513 | 97 | As is | by synthesis |
| P-502953310 | 90 | As is | in stock |
| P-873248151 | 97 | As is | 5 mg |
| P-14237554 | 90 | As is | 292 mg |
| P-869095927 | 95 | As is | in stock |
| P-596714367 | 90 | As is | 5 mg |
| P-906892031 | 98 | As is | by synthesis |
| P-611455120 | 90 | As is | in stock |
| P-894004824 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 452.455 |
| logP | 2.8148 |
| H-bond acceptors | 9 |
| H-bond donors | 1 |
| Rotatable bonds | 9 |
| PSA | 105.09 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 121.1787 |
| Atoms | 57 |
| Rings | 4 |
| Heavy atoms | 33 |
| Hydrogen atoms | 24 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| 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 |
