MCULE-2253997186
- 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.
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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.
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1 mg | 101 USD | 95 | 14 working days | Get Quote |
5 mg | 101 USD | 95 | 14 working days | Get Quote |
10 mg | 127 USD | 98 | 16 working days | Get Quote |
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MCULE-4612302568
- Component type: Main
Name | File |
---|---|
SDF | MCULE-2253997186.sdf |
SMILES | MCULE-2253997186.smiles |
Standard InChI | MCULE-2253997186.inchi |
InChIKey | MCULE-2253997186.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-666963080 | BLD pharm | In-stock building blocks | 98 | As is | 463 mg |
P-610963009 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As a main component | 4.019 g |
P-666963332 | BLD pharm | In-stock building blocks | 98 | As a main component | 508 mg |
P-579722078 | Chemshuttle | Stock catalog | 95 | As a main component | 12 mg |
P-861488469 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
P-852489830 | Matrix Scientific | All | N/A | As a main component | in stock |
P-854718001 | MedChemExpress | Screening compounds In stock | 95 | As a main component | in stock |
P-579710699 | Selleckchem | Product Catalog | N/A | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 499.519 |
logP | 0.8807 |
H-bond acceptors | 13 |
H-bond donors | 6 |
Rotatable bonds | 11 |
PSA | 197.74 |
RO5 violations | 2 |
RO3 violations | 5 |
Refractivity | 129.0792 |
Atoms | 65 |
Rings | 4 |
Heavy atoms | 36 |
Hydrogen atoms | 29 |
Heteroatoms | 13 |
N/O atoms | 13 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 4 |
R/S chiral centers | 4 |
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 |