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RELATIVE STEREO
MCULE-7702377679
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 | 49 USD | 95 | 27 working days | Get Quote |
| 5 mg | 49 USD | 95 | 27 working days | Get Quote |
| 10 mg | 49 USD | 95 | 27 working days | Get Quote |
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MCULE-1122238661
- Component type: Unknown
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MCULE-4421688956
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7702377679.sdf |
| SMILES | MCULE-7702377679.smiles |
| Standard InChI | MCULE-7702377679.inchi |
| InChIKey | MCULE-7702377679.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1273455335 | 95 | As is | by resynthesis (? - ? days) |
| P-868958585 | 98 | As is | in stock |
| P-1273266023 | 95 | As a component | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 195.214 |
| logP | -2.9674 |
| H-bond acceptors | 6 |
| H-bond donors | 6 |
| Rotatable bonds | 6 |
| PSA | 113.18 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 44.3737 |
| Atoms | 30 |
| Rings | 0 |
| Heavy atoms | 13 |
| Hydrogen atoms | 17 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
