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MCULE-2893545241
Compound
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- InChIKey:
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- InChI:
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| 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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 52 USD | 90 | 19 working days | Get Quote |
| 10 mg | 66 USD | 90 | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2893545241.sdf |
| SMILES | MCULE-2893545241.smiles |
| Standard InChI | MCULE-2893545241.inchi |
| InChIKey | MCULE-2893545241.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-83271 | Chemical Block | Screening Library | 90 | As is | 319 mg |
| P-504763842 | ChemBridge | EXPRESS-Pick Collection | 90 | As an isomer | 50 mg |
| P-4892781 | ChemDiv | Discovery Chemistry Library | 90 | As an isomer | 17 mg |
| P-34754822 | Crea-Chim | HTS compounds | 90 | As an isomer | by resynthesis (? - ? days) |
| P-31137105 | LaboTest | Screening Collection | 90 | As an isomer | 500 mg |
| P-12439471 | Specs | Screening Compounds | 90 | As an isomer | 129 mg |
| P-33452976 | TimTec | ActiMol 3 Week | 90 | As an isomer | in stock |
| P-2343386 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As an isomer | 55 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 513.653 |
| logP | 8.18 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 5 |
| PSA | 62.9 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 163.587 |
| Atoms | 65 |
| Rings | 6 |
| Heavy atoms | 38 |
| Hydrogen atoms | 27 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 | 2 |
| Cis/trans stereo double bonds | 2 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
