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MCULE-3253978556
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 | 13 USD | 98 | 11 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3253978556.sdf |
| SMILES | MCULE-3253978556.smiles |
| Standard InChI | MCULE-3253978556.inchi |
| InChIKey | MCULE-3253978556.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-489191981 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-871220280 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-852001800 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-851247432 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868629059 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-579478638 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-854718580 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-608270153 | Molnova | Stock | 98 | As is | in stock |
| P-873279409 | Shanghai iChemical | In stock | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 807.877 |
| logP | 3.6505 |
| H-bond acceptors | 15 |
| H-bond donors | 5 |
| Rotatable bonds | 14 |
| PSA | 224.45 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 205.2534 |
| Atoms | 111 |
| Rings | 6 |
| Heavy atoms | 58 |
| Hydrogen atoms | 53 |
| Heteroatoms | 15 |
| N/O atoms | 15 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 11 |
| R/S chiral centers | 11 |
| 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 |
