MCULE-1584643139
- 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 | 46 USD | 90 | 21 working days | Get Quote |
5 mg | 70 USD | 90 | 21 working days | Get Quote |
10 mg | 82 USD | 90 | 21 working days | Get Quote |
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Name | File |
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SDF | MCULE-1584643139.sdf |
SMILES | MCULE-1584643139.smiles |
Standard InChI | MCULE-1584643139.inchi |
InChIKey | MCULE-1584643139.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886007082 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-505365036 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-425436280 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-5728444 | ChemDiv | Discovery Chemistry Library | 90 | As is | 113 mg |
P-579492345 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
P-14221656 | Life Chemicals | Screening Compounds | 90 | As is | 49 mg |
P-859962889 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 491.579 |
logP | 6.2653 |
H-bond acceptors | 6 |
H-bond donors | 1 |
Rotatable bonds | 5 |
PSA | 74.91 |
RO5 violations | 1 |
RO3 violations | 5 |
Refractivity | 149.7137 |
Atoms | 66 |
Rings | 6 |
Heavy atoms | 37 |
Hydrogen atoms | 29 |
Heteroatoms | 6 |
N/O atoms | 6 |
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 | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 1 |
Undefined stereo double bonds | 0 |