MCULE-6652110159
- 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 | 44 USD | 90 | 21 working days | Get Quote |
5 mg | 71 USD | 90 | 21 working days | Get Quote |
10 mg | 85 USD | 90 | 21 working days | Get Quote |
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Name | File |
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SDF | MCULE-6652110159.sdf |
SMILES | MCULE-6652110159.smiles |
Standard InChI | MCULE-6652110159.inchi |
InChIKey | MCULE-6652110159.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-502821713 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-26364848 | Otava | In-House Stock Library | 90 | As is | 50 mg |
P-19497675 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-33927385 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
Property | Value |
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Components | 1 |
Mass | 470.489 |
logP | 2.7163 |
H-bond acceptors | 8 |
H-bond donors | 2 |
Rotatable bonds | 8 |
PSA | 99.54 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 129.4433 |
Atoms | 61 |
Rings | 4 |
Heavy atoms | 34 |
Hydrogen atoms | 27 |
Heteroatoms | 9 |
N/O atoms | 8 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
Chiral centers | 1 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 1 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |