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MCULE-3246139095
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 | 167 USD | 95 | 14 working days | Get Quote |
| 5 mg | 167 USD | 95 | 14 working days | Get Quote |
| 10 mg | 333 USD | 95 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3246139095.sdf |
| SMILES | MCULE-3246139095.smiles |
| Standard InChI | MCULE-3246139095.inchi |
| InChIKey | MCULE-3246139095.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867642775 | 98 | As is | in stock |
| P-901274806 | 98 | As is | in stock |
| P-489243071 | 97 | As is | in stock |
| P-895182046 | 95 | As is | in stock |
| P-869134319 | 95 | As is | unavailable |
| P-888643874 | 95 | As is | unavailable |
| P-886937758 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 653.814 |
| logP | 6.8443 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 12 |
| PSA | 99.15 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 200.9349 |
| Atoms | 92 |
| Rings | 7 |
| Heavy atoms | 49 |
| Hydrogen atoms | 43 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| 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 |
