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MCULE-5968887818
Compound
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- InChIKey:
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- 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 | 44 USD | 90 | 21 working days | Get Quote |
| 5 mg | 71 USD | 90 | 21 working days | Get Quote |
| 10 mg | 85 USD | 90 | 21 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-5968887818.sdf |
| SMILES | MCULE-5968887818.smiles |
| Standard InChI | MCULE-5968887818.inchi |
| InChIKey | MCULE-5968887818.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596407464 | Asinex | General screening catalog | 90 | As is | 106 mg |
| P-504654306 | ChemBridge | RUSH - EXPRESS PICK LIBRARY | 90 | As is | 5 mg |
| P-4425595 | ChemDiv | Discovery Chemistry Library | 90 | As is | unavailable |
| P-502832413 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-12833489 | Otava | In-House Stock Library | 90 | As is | 243 mg |
| P-23298657 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 421.445 |
| logP | 4.4362 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 10 |
| PSA | 106.62 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 117.7724 |
| Atoms | 54 |
| Rings | 3 |
| Heavy atoms | 31 |
| Hydrogen atoms | 23 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |
