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MCULE-4471696932
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 | 104 USD | 95 | 34 working days | Get Quote |
| 5 mg | 104 USD | 95 | 34 working days | Get Quote |
| 10 mg | 104 USD | 95 | 34 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4471696932.sdf |
| SMILES | MCULE-4471696932.smiles |
| Standard InChI | MCULE-4471696932.inchi |
| InChIKey | MCULE-4471696932.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852156337 | 95 | As is | by synthesis |
| P-890043626 | N/A | As is | by synthesis |
| P-894618473 | 95 | As is | in stock |
| P-851894820 | N/A | As is | by synthesis |
| P-901362638 | 95 | As is | by synthesis |
| P-591168328 | 95 | As is | by synthesis |
| P-454734610 | 90 | As is | in stock |
| P-436473865 | 95 | As is | in stock |
| P-861539473 | 95 | As is | by synthesis |
| P-855977982 | 95 | As is | 5 g |
| P-852533744 | N/A | As is | in stock |
| P-502374394 | 90 | As is | in stock |
| P-22528590 | 90 | As is | 70 mg |
| P-855348171 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 279.248 |
| logP | 2.2098 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 115.46 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 75.6625 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 13 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
