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MCULE-4712987402-0
Structure
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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 | 8 USD | 98 | 20 working days | Get Quote |
| 5 mg | 8 USD | 98 | 20 working days | Get Quote |
| 10 mg | 8 USD | 98 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4712987402-0.sdf |
| SMILES | MCULE-4712987402-0.smiles |
| Standard InChI | MCULE-4712987402-0.inchi |
| InChIKey | MCULE-4712987402-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867582666 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875741236 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869189398 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-579760044 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-856058381 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-34856322 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606912190 | AmBeed | In stock | N/A | As is | in stock |
| P-489148488 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596953177 | Angene | Building Blocks in stock | 98 | As is | 1000 g |
| P-895931327 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-869615090 | Asinex | General screening catalog | 90 | As is | 49 mg |
| P-864115697 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590638685 | BLD pharm | In-stock building blocks | 98 | As is | 80 g |
| P-893235053 | Biosynth | In Stock | 95 | As is | in stock |
| P-448676578 | ChemDiv | Discovery Chemistry Library | 90 | As is | 68 mg |
| P-868603589 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580442181 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889112560 | FluoroChem | In Stock BB | 98 | As is | 158 g |
| P-596603049 | Key Organics | Building Blocks | 95 | As is | 181.7 g |
| P-31179855 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-856042999 | LaboTest | Building Blocks | 90 | As is | unavailable |
| P-869382507 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-35163560 | Maybridge | Screening Collection | 90 | As is | 10.668 kg |
| P-854755921 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-500398097 | Pi Chemicals | Virtual Compounds | 99 | As is | by synthesis |
| P-18911311 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-889882363 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502366149 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888440510 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-855348262 | Toronto Research | In stock | 90 | As is | in stock |
| P-372300 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 39 mg |
| P-3243512 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 39 mg |
| P-893980427 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 180.161 |
| logP | 2.1494 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 74.92 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 49.5767 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
