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MCULE-1632565172-0
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 | 20 USD | 95 | 20 working days | Get Quote |
| 5 mg | 20 USD | 95 | 20 working days | Get Quote |
| 10 mg | 20 USD | 95 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1632565172-0.sdf |
| SMILES | MCULE-1632565172-0.smiles |
| Standard InChI | MCULE-1632565172-0.inchi |
| InChIKey | MCULE-1632565172-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-860613845 | N/A | As is | by synthesis |
| P-890158761 | N/A | As is | in stock |
| P-903155953 | 95 | As is | 9 g |
| P-851420935 | N/A | As is | by synthesis |
| P-888819314 | 95 | As is | 9 g |
| P-905469302 | 95 | As is | in stock |
| P-901864304 | 95 | As is | by synthesis |
| P-893257445 | 95 | As is | by synthesis |
| P-870648233 | N/A | As is | in stock |
| P-31177242 | 90 | As is | unavailable |
| P-869019556 | 95 | As is | by synthesis |
| P-635682421 | 90 | As is | by synthesis |
| P-906905212 | 98 | As is | in stock |
| P-906866156 | 95 | As is | by synthesis |
| P-855351163 | 90 | As is | in stock |
| P-894007474 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 202.251 |
| logP | 1.0403 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 6 |
| PSA | 92.42 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 52.8579 |
| Atoms | 32 |
| Rings | 0 |
| Heavy atoms | 14 |
| Hydrogen atoms | 18 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
