MCULE-6892406702-0
- 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 | 96 | 15 working days | Get Quote |
| 5 mg | 46 USD | 98 | 11 working days | Get Quote |
| 10 mg | 46 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6892406702-0.sdf |
| SMILES | MCULE-6892406702-0.smiles |
| Standard InChI | MCULE-6892406702-0.inchi |
| InChIKey | MCULE-6892406702-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867637227 | 96 | As is | in stock |
| P-875802033 | 96 | As is | in stock |
| P-869208706 | 95 | As is | by resynthesis (? - ? days) |
| P-1264050040 | 99 | As is | in stock |
| P-893524189 | 90 | As is | 9.469 g |
| P-1270275418 | 96 | As is | in stock |
| P-606941253 | N/A | As is | in stock |
| P-489212743 | 97 | As is | in stock |
| P-438400037 | 85 | As is | 1 mg |
| P-596967891 | 96 | As is | 250 mg |
| P-866726895 | 95 | As is | 5 mg |
| P-864154401 | 95 | As is | in stock |
| P-500415473 | 95 | As is | by synthesis |
| P-584629082 | 96 | As is | 1.184 g |
| P-893237323 | 95 | As is | in stock |
| P-452653565 | 98 | As is | in stock |
| P-1272277233 | 95 | As is | by synthesis |
| P-861367581 | 95 | As is | by synthesis |
| P-579477645 | 95 | As is | in stock |
| P-901407823 | 96 | As is | 750 mg |
| P-675219127 | 95 | As is | in stock |
| P-13905794 | 92 | As is | 300 mg |
| P-596577795 | 95 | As is | 5 mg |
| P-854692565 | 95 | As is | in stock |
| P-896629258 | 95 | As is | by synthesis |
| P-608279844 | 98 | As is | in stock |
| P-889874701 | 95 | As is | by synthesis |
| P-868145325 | 90 | As is | in stock |
| P-869178114 | 95 | As is | in stock |
| P-892298135 | 95 | As is | unavailable |
| P-580052432 | 95 | As is | 53 mg |
| P-892347031 | 95 | As is | 53 mg |
| P-906874940 | 95 | As is | by synthesis |
| P-855344161 | 90 | As is | in stock |
| P-594194967 | 90 | As is | 55 mg |
| P-1271718115 | 96 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 314.288 |
| logP | 2.8884 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 89.13 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 84.95 |
| Atoms | 37 |
| Rings | 3 |
| Heavy atoms | 23 |
| Hydrogen atoms | 14 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |

