MCULE-8226707133
- 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 | 139 USD | 97 | 8 working days | Get Quote |
5 mg | 195 USD | 97 | 8 working days | Get Quote |
10 mg | 391 USD | 97 | 8 working days | Get Quote |
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Name | File |
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SDF | MCULE-8226707133.sdf |
SMILES | MCULE-8226707133.smiles |
Standard InChI | MCULE-8226707133.inchi |
InChIKey | MCULE-8226707133.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-869364043 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-868543620 | Axon Medchem | Axon predominantly SC catalog | 97 | As is | in stock |
P-888632179 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
P-869116703 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
P-611472016 | Toronto Research | In stock | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 578.724 |
logP | 5.2809 |
H-bond acceptors | 9 |
H-bond donors | 4 |
Rotatable bonds | 15 |
PSA | 136.22 |
RO5 violations | 2 |
RO3 violations | 6 |
Refractivity | 160.0779 |
Atoms | 79 |
Rings | 4 |
Heavy atoms | 41 |
Hydrogen atoms | 38 |
Heteroatoms | 10 |
N/O atoms | 9 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 3 |
R/S chiral centers | 3 |
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 |