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MCULE-7813007781
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 | 250 USD | 95 | 14 working days | Get Quote |
| 5 mg | 624 USD | 95 | 14 working days | Get Quote |
| 10 mg | 1020 USD | 95 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-7813007781.sdf |
| SMILES | MCULE-7813007781.smiles |
| Standard InChI | MCULE-7813007781.inchi |
| InChIKey | MCULE-7813007781.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1265855029 | 98 | As is | in stock |
| P-894613522 | 95 | As is | by resynthesis (? - ? days) |
| P-904320258 | 90 | As is | 1.851 g |
| P-1271972031 | N/A | As is | 10 mg |
| P-1273293751 | 95 | As is | by resynthesis (? - ? days) |
| P-901502880 | 95 | As is | by synthesis |
| P-1274908127 | 95 | As is | by synthesis |
| P-580410872 | 95 | As is | by resynthesis (? - ? days) |
| P-873246936 | 97 | As is | 5 mg |
| P-854712525 | 95 | As is | in stock |
| P-904245396 | 95 | As is | unavailable |
| P-869117669 | 95 | As is | 8 mg |
| P-888632848 | 95 | As is | 8 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 418.441 |
| logP | 5.2552 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 5 |
| PSA | 82.28 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 116.6761 |
| Atoms | 51 |
| Rings | 5 |
| Heavy atoms | 31 |
| Hydrogen atoms | 20 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
