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MCULE-9277129899
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 | 62 USD | 90 | 22 working days | Get Quote |
| 5 mg | 77 USD | 90 | 22 working days | Get Quote |
| 10 mg | 101 USD | 90 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9277129899.sdf |
| SMILES | MCULE-9277129899.smiles |
| Standard InChI | MCULE-9277129899.inchi |
| InChIKey | MCULE-9277129899.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596433845 | Asinex | General screening catalog | 90 | As is | 116 mg |
| P-6701755 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 10 mg |
| P-674227512 | ChemDiv | Discovery Chemistry Library | 90 | As is | 14 mg |
| P-34552072 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-22724299 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-873068782 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-873060277 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 437.449 |
| logP | 4.71278 |
| H-bond acceptors | 8 |
| H-bond donors | 3 |
| Rotatable bonds | 5 |
| PSA | 140.04 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 121.1635 |
| Atoms | 52 |
| Rings | 5 |
| Heavy atoms | 33 |
| Hydrogen atoms | 19 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
