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MCULE-5959440652
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 | 33 USD | 90 | 17 working days | Get Quote |
| 5 mg | 35 USD | 90 | 17 working days | Get Quote |
| 10 mg | 41 USD | 90 | 17 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-5959440652.sdf |
| SMILES | MCULE-5959440652.smiles |
| Standard InChI | MCULE-5959440652.inchi |
| InChIKey | MCULE-5959440652.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852069867 | A2B Chem | Predominantly Building Block on demand | 90 | As is | by synthesis |
| P-853439767 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-19877520 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851901028 | AmBeed | On request | N/A | As is | by synthesis |
| P-4598553 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
| P-861301406 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-580303322 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-502446138 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503893483 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-502756693 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-454401909 | Key Organics | Building Blocks | 90 | As is | 8.485 g |
| P-18791591 | Key Organics | Screening Compounds and Fragments | 90 | As is | 8.485 g |
| P-856013363 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-35204302 | Maybridge | Screening Collection | 97 | As is | 10.346 kg |
| P-26457766 | Otava | In-House Stock Library | 90 | As is | 55 mg |
| P-19513197 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-22774250 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502393971 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888432094 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-855335343 | Toronto Research | In stock | 90 | As is | in stock |
| P-2977331 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 13 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 172.183 |
| logP | 1.77918 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 66.88 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 48.8034 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 8 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
