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MCULE-4543644267
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 | 116 USD | 95 | 8 working days | Get Quote |
| 5 mg | 166 USD | 98 | 12 working days | Get Quote |
| 10 mg | 217 USD | 97 | 27 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4543644267.sdf |
| SMILES | MCULE-4543644267.smiles |
| Standard InChI | MCULE-4543644267.inchi |
| InChIKey | MCULE-4543644267.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-872728742 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-872728849 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-870660199 | Glentham Life Sciences | Compounds typically in stock | 98 | As is | in stock |
| P-870663123 | Glentham Life Sciences | Compounds maintained in stock | 95 | As is | in stock |
| P-855916034 | Key Organics | Building Blocks | 97 | As is | 5 mg |
| P-873251239 | Key Organics | Building Blocks | 97 | As is | 1 mg |
| P-873251238 | Key Organics | Building Blocks | 97 | As is | 1 mg |
| P-855960883 | Key Organics | Building Blocks | 97 | As is | 10 mg |
| P-885559967 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 578.518 |
| logP | 2.995 |
| H-bond acceptors | 12 |
| H-bond donors | 10 |
| Rotatable bonds | 3 |
| PSA | 220.76 |
| RO5 violations | 3 |
| RO3 violations | 4 |
| Refractivity | 146.7126 |
| Atoms | 68 |
| Rings | 6 |
| Heavy atoms | 42 |
| Hydrogen atoms | 26 |
| Heteroatoms | 12 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 5 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
