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UNKNOWN STEREO
MCULE-4060010485
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 | 258 USD | 96 | 12 working days | Get Quote |
| 5 mg | 258 USD | 96 | 12 working days | Get Quote |
| 10 mg | 258 USD | 96 | 12 working days | Get Quote |
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MCULE-7386719463
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4060010485.sdf |
| SMILES | MCULE-4060010485.smiles |
| Standard InChI | MCULE-4060010485.inchi |
| InChIKey | MCULE-4060010485.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266389772 | 95 | As is | by synthesis |
| P-1264940790 | 95 | As is | by synthesis |
| P-904513944 | 95 | As is | by resynthesis (? - ? days) |
| P-851836007 | N/A | As is | by synthesis |
| P-895103184 | 95 | As is | 53 g |
| P-872696413 | 95 | As is | in stock |
| P-500177174 | 96 | As is | in stock |
| P-892272019 | 95 | As is | unavailable |
| P-892349316 | 95 | As is | unavailable |
| P-611495707 | 90 | As is | in stock |
| P-854664478 | 95 | As is | in stock |
| P-894633351 | 95 | As a main component | by resynthesis (? - ? days) |
| P-851807776 | N/A | As a main component | by synthesis |
| P-864225867 | 95 | As a main component | by synthesis |
| P-500177177 | 96 | As a main component | in stock |
| P-854664479 | 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 |
