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MCULE-1013581106
Compound
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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 | 108 USD | 90 | 20 working days | Get Quote |
| 5 mg | 108 USD | 90 | 20 working days | Get Quote |
| 10 mg | 108 USD | 90 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1013581106.sdf |
| SMILES | MCULE-1013581106.smiles |
| Standard InChI | MCULE-1013581106.inchi |
| InChIKey | MCULE-1013581106.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596294502 | Asinex | General screening catalog | 90 | As is | 66 mg |
| P-856030867 | LaboTest | Screening Collection | 90 | As is | 30 mg |
| P-454069514 | Specs | Screening Compounds | 90 | As is | 12 mg |
| P-23171128 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 382.283 |
| logP | 3.6974 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 41.9 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 94.189 |
| Atoms | 38 |
| Rings | 3 |
| Heavy atoms | 27 |
| Hydrogen atoms | 11 |
| Heteroatoms | 9 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 5 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
