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MCULE-8460751648-0
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 | 6 USD | 97 | 14 working days | Get Quote |
| 5 mg | 6 USD | 97 | 14 working days | Get Quote |
| 10 mg | 6 USD | 97 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-8460751648-0.sdf |
| SMILES | MCULE-8460751648-0.smiles |
| Standard InChI | MCULE-8460751648-0.inchi |
| InChIKey | MCULE-8460751648-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903057916 | 97 | As is | 500 g |
| P-905489336 | 95 | As is | 10 g |
| P-893553873 | 90 | As is | 4.34706 kg |
| P-895912470 | 95 | As is | by resynthesis (? - ? days) |
| P-580697332 | 95 | As is | 161 g |
| P-868628774 | 95 | As is | in stock |
| P-905326600 | 95 | As is | 4 g |
| P-901407515 | 95 | As is | 922.903 g |
| P-856078764 | 95 | As is | unavailable |
| P-584614273 | 95 | As is | in stock |
| P-878645225 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 507.181 |
| logP | -1.0478 |
| H-bond acceptors | 18 |
| H-bond donors | 7 |
| Rotatable bonds | 8 |
| PSA | 308.56 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 95.4047 |
| Atoms | 47 |
| Rings | 3 |
| Heavy atoms | 31 |
| Hydrogen atoms | 16 |
| Heteroatoms | 21 |
| N/O atoms | 18 |
| 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 |
