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MCULE-5831442069-0
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 | 45 USD | 95 | 14 working days | Get Quote |
| 5 mg | 45 USD | 95 | 14 working days | Get Quote |
| 10 mg | 45 USD | 95 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5831442069-0.sdf |
| SMILES | MCULE-5831442069-0.smiles |
| Standard InChI | MCULE-5831442069-0.inchi |
| InChIKey | MCULE-5831442069-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892877257 | 95 | As is | in stock |
| P-890181028 | 95 | As is | in stock |
| P-892794350 | 95 | As is | by resynthesis (? - ? days) |
| P-903293513 | 95 | As is | 10 g |
| P-1270389467 | 95 | As is | in stock |
| P-851656652 | N/A | As is | by synthesis |
| P-489160373 | 97 | As is | in stock |
| P-888826637 | 95 | As is | 4.25 g |
| P-494329855 | 95 | As is | by resynthesis (? - ? days) |
| P-889786554 | 95 | As is | in stock |
| P-889733147 | 95 | As is | by synthesis |
| P-889286433 | 97 | As is | 800 mg |
| P-31275748 | 90 | As is | 10 g |
| P-856044408 | 90 | As is | 10 g |
| P-1272493836 | 95 | As is | in stock |
| P-500404553 | 98 | As is | by synthesis |
| P-906902384 | 95 | As is | in stock |
| P-1271684256 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 246.196 |
| logP | 1.4105 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 137.35 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 50.2194 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 6 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| 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 |
