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MCULE-2988788046
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.
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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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 52 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 working days | Get Quote |
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1
MCULE-4044607550
- Component type: Main
-
1
MCULE-9920754312
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2988788046.sdf |
| SMILES | MCULE-2988788046.smiles |
| Standard InChI | MCULE-2988788046.inchi |
| InChIKey | MCULE-2988788046.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596354527 | Asinex | General screening catalog | 90 | Main component | 68 mg |
| P-674249978 | ChemDiv | Discovery Chemistry Library | 90 | Main component | 12 mg |
| P-12469525 | InterBioScreen | Screening Compounds | 92 | Main component | 56 mg |
| P-579424521 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-873065949 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-24779984 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 21 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 512.593 |
| logP | 4.3034 |
| H-bond acceptors | 9 |
| H-bond donors | 3 |
| Rotatable bonds | 11 |
| PSA | 125.4 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 145.7903 |
| Atoms | 73 |
| Rings | 3 |
| Heavy atoms | 37 |
| Hydrogen atoms | 36 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
