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MCULE-4104593635
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 | 33 USD | 90 | 17 working days | Get Quote |
| 5 mg | 50 USD | 90 | 17 working days | Get Quote |
| 10 mg | 64 USD | 90 | 17 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4104593635.sdf |
| SMILES | MCULE-4104593635.smiles |
| Standard InChI | MCULE-4104593635.inchi |
| InChIKey | MCULE-4104593635.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886173675 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-502654673 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-503033600 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-12901076 | InterBioScreen | Screening Compounds | 92 | As is | 237 mg |
| P-14229436 | Life Chemicals | Screening Compounds | 90 | As is | 25 mg |
| P-12520550 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-13805161 | Pharmeks LLC | Synthetic compounds | 92 | As is | in stock |
| P-18863556 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-579351688 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-2277767 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 84 mg |
| P-2060223 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 50 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 432.521 |
| logP | 3.7233 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 143.97 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 113.0167 |
| Atoms | 49 |
| Rings | 3 |
| Heavy atoms | 29 |
| Hydrogen atoms | 20 |
| Heteroatoms | 10 |
| N/O atoms | 8 |
| 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 | 1 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
