MCULE-6923790139
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
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Guaranteed purity (%) | Delivery time
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1 mg | 35 USD | 90 | 17 working days | Get Quote |
5 mg | 53 USD | 90 | 17 working days | Get Quote |
10 mg | 67 USD | 90 | 17 working days | Get Quote |
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MCULE-7303936678
- Component type: Main
Name | File |
---|---|
SDF | MCULE-6923790139.sdf |
SMILES | MCULE-6923790139.smiles |
Standard InChI | MCULE-6923790139.inchi |
InChIKey | MCULE-6923790139.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-5624842 | ChemBridge | EXPRESS-Pick Collection | 90 | As a main component | 10 mg |
P-675077052 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
P-617755836 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 14 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 398.494 |
logP | 3.6567 |
H-bond acceptors | 6 |
H-bond donors | 2 |
Rotatable bonds | 9 |
PSA | 71.03 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 117.0567 |
Atoms | 59 |
Rings | 3 |
Heavy atoms | 29 |
Hydrogen atoms | 30 |
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 | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |