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MCULE-4270137330
Compound
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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 | 46 USD | 90 | 23 working days | Get Quote |
| 5 mg | 70 USD | 90 | 22 working days | Get Quote |
| 10 mg | 88 USD | 90 | 23 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4270137330.sdf |
| SMILES | MCULE-4270137330.smiles |
| Standard InChI | MCULE-4270137330.inchi |
| InChIKey | MCULE-4270137330.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-5175193 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 40 mg |
| P-3731858 | ChemDiv | Discovery Chemistry Library | 90 | As is | 41 mg |
| P-502728790 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502733520 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-621083355 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-12303695 | Otava | In-House Stock Library | 90 | As is | 104 mg |
| P-33862114 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 394.231 |
| logP | 5.6452 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 112.58 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 106.1127 |
| Atoms | 34 |
| Rings | 3 |
| Heavy atoms | 25 |
| Hydrogen atoms | 9 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 | 1 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
