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UNKNOWN STEREO
MCULE-3859998796-0
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 | 12 USD | 99 | 20 working days | Get Quote |
| 5 mg | 12 USD | 99 | 20 working days | Get Quote |
| 10 mg | 20 USD | 98 | 22 working days | Get Quote |
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MCULE-6745061181-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3859998796-0.sdf |
| SMILES | MCULE-3859998796-0.smiles |
| Standard InChI | MCULE-3859998796-0.inchi |
| InChIKey | MCULE-3859998796-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867569649 | 98 | As is | in stock |
| P-875730073 | 98 | As is | in stock |
| P-1275198625 | 98 | As is | in stock |
| P-864133308 | 95 | As is | in stock |
| P-868544075 | 99 | As is | in stock |
| P-893238756 | 95 | As is | in stock |
| P-860797876 | 98 | As is | in stock |
| P-580452247 | 99 | As is | in stock |
| P-500177060 | 96 | As is | in stock |
| P-500410118 | 98 | As is | by synthesis |
| P-869134609 | 95 | As is | 106 mg |
| P-888643996 | 95 | As is | 106 mg |
| P-867603330 | N/A | As a main component | in stock |
| P-875761701 | 99 | As a main component | in stock |
| P-615726046 | 98 | As a main component | by resynthesis (? - ? days) |
| P-875889638 | 99 | As a main component | 5 mg |
| P-864136186 | 95 | As a main component | in stock |
| P-868545282 | 99 | As a main component | in stock |
| P-675213653 | 95 | As a main component | in stock |
| P-500177061 | 96 | As a main component | in stock |
| P-855325032 | 90 | As a main component | in stock |
| P-893934130 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 244.292 |
| logP | 2.2895 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 83.8 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 72.8683 |
| Atoms | 34 |
| Rings | 3 |
| Heavy atoms | 18 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
