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MCULE-9698046612
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 | 382 USD | 70 | 17 working days | Get Quote |
| 5 mg | 670 USD | 95 | 27 working days | Get Quote |
| 10 mg | 1247 USD | 70 | 17 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9698046612.sdf |
| SMILES | MCULE-9698046612.smiles |
| Standard InChI | MCULE-9698046612.inchi |
| InChIKey | MCULE-9698046612.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892865750 | 98 | As is | in stock |
| P-901275096 | 98 | As is | in stock |
| P-853434736 | 95 | As is | by resynthesis (? - ? days) |
| P-1264058243 | 98 | As is | in stock |
| P-907351525 | 90 | As is | 25 mg |
| P-580235752 | 95 | As is | by synthesis |
| P-25948060 | 70 | As is | 100 mg |
| P-1275108600 | N/A | As is | by resynthesis (? - ? days) |
| P-901490009 | 95 | As is | by synthesis |
| P-1274910488 | 95 | As is | by synthesis |
| P-878209915 | 95 | As is | 5 mg |
| P-874452678 | 95 | As is | in stock |
| P-892306654 | 95 | As is | in stock |
| P-869168548 | 95 | As is | unavailable |
| P-888661980 | 95 | As is | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 420.453 |
| logP | 5.2697 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 100.13 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 121.83 |
| Atoms | 55 |
| Rings | 4 |
| Heavy atoms | 31 |
| Hydrogen atoms | 24 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
