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MCULE-3986737532
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 | 112 USD | 98 | 22 working days | Get Quote |
| 5 mg | 162 USD | 98 | 22 working days | Get Quote |
| 10 mg | 294 USD | 98 | 22 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-5592321229
- Component type: Main
-
1
MCULE-9976402631
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3986737532.sdf |
| SMILES | MCULE-3986737532.smiles |
| Standard InChI | MCULE-3986737532.inchi |
| InChIKey | MCULE-3986737532.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-854711468 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-893606557 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 1.06 g |
| P-868361616 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-887194965 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-868659525 | DC Chemicals Limited | Stock Products | 95 | Main component | in stock |
| P-854621888 | Excenen | Excenen compounds | 98 | Main component | in stock |
| P-854717121 | MedChemExpress | Screening compounds In stock | 95 | Main component | in stock |
| P-872684269 | MedKoo | In stock compounds | 95 | Main component | in stock |
| P-888170259 | Molnova | On demand | 98 | Main component | by synthesis |
| P-617404414 | Selleckchem | Product Catalog | N/A | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 629.629 |
| logP | 4.9578 |
| H-bond acceptors | 12 |
| H-bond donors | 5 |
| Rotatable bonds | 13 |
| PSA | 159.76 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 164.0731 |
| Atoms | 79 |
| Rings | 4 |
| Heavy atoms | 45 |
| Hydrogen atoms | 34 |
| Heteroatoms | 15 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
