MCULE-9368511893
- 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 | 130 USD | 90 | 27 working days | Get Quote |
5 mg | 130 USD | 90 | 27 working days | Get Quote |
10 mg | 130 USD | 90 | 27 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-9368511893.sdf |
SMILES | MCULE-9368511893.smiles |
Standard InChI | MCULE-9368511893.inchi |
InChIKey | MCULE-9368511893.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-502626483 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-503102015 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-18986038 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-33820304 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
Property | Value |
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Components | 1 |
Mass | 282.319 |
logP | 3.3875 |
H-bond acceptors | 4 |
H-bond donors | 0 |
Rotatable bonds | 2 |
PSA | 75.57 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 82.064 |
Atoms | 30 |
Rings | 3 |
Heavy atoms | 20 |
Hydrogen atoms | 10 |
Heteroatoms | 5 |
N/O atoms | 4 |
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 |