MCULE-8006507483
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
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Guaranteed purity (%) | Delivery time
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1 mg | 37 USD | 90 | 22 working days | Get Quote |
5 mg | 45 USD | 90 | 22 working days | Get Quote |
10 mg | 60 USD | 90 | 22 working days | Get Quote |
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MCULE-2082224379
- Component type: Main
Name | File |
---|---|
SDF | MCULE-8006507483.sdf |
SMILES | MCULE-8006507483.smiles |
Standard InChI | MCULE-8006507483.inchi |
InChIKey | MCULE-8006507483.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-3759202 | ChemBridge | EXPRESS-Pick Collection | 90 | As a main component | 100 mg |
P-675444694 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 241.369 |
logP | 2.1204 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 5 |
PSA | 32.7 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 74.2418 |
Atoms | 44 |
Rings | 2 |
Heavy atoms | 17 |
Hydrogen atoms | 27 |
Heteroatoms | 3 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
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 |