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MCULE-1881458947
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 | 237 USD | N/A | 22 working days | Get Quote |
| 5 mg | 237 USD | N/A | 22 working days | Get Quote |
| 10 mg | 367 USD | N/A | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1881458947.sdf |
| SMILES | MCULE-1881458947.smiles |
| Standard InChI | MCULE-1881458947.inchi |
| InChIKey | MCULE-1881458947.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266268232 | N/A | As is | in stock |
| P-901305310 | N/A | As is | in stock |
| P-505401615 | 95 | As is | by resynthesis (? - ? days) |
| P-893454405 | 90 | As is | 1000 mg |
| P-900251862 | N/A | As is | 500 mg |
| P-1273452464 | 95 | As is | by resynthesis (? - ? days) |
| P-851313935 | 95 | As is | by synthesis |
| P-1274906760 | 95 | As is | by synthesis |
| P-1264287142 | 95 | As is | 500 mg |
| P-524166983 | 95 | As is | 5 mg |
| P-1272061371 | 95 | As is | in stock |
| P-589631684 | 98 | As is | in stock |
| P-892298373 | 95 | As is | unavailable |
| P-892270492 | 95 | As is | 2.845 g |
| P-892348442 | 95 | As is | 2.845 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 431.885 |
| logP | 3.9516 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 69.72 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 119.3077 |
| Atoms | 53 |
| Rings | 3 |
| Heavy atoms | 30 |
| Hydrogen atoms | 23 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
