MCULE-7015383404
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- InChI:
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MCULE-9575812028
- Component type: Main
Name | File |
---|---|
SDF | MCULE-7015383404.sdf |
SMILES | MCULE-7015383404.smiles |
Standard InChI | MCULE-7015383404.inchi |
InChIKey | MCULE-7015383404.txt |
Property | Value |
---|---|
Components | 1 |
Mass | 332.350 |
logP | 3.8245 |
H-bond acceptors | 7 |
H-bond donors | 1 |
Rotatable bonds | 8 |
PSA | 85.54 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 91.8017 |
Atoms | 44 |
Rings | 2 |
Heavy atoms | 24 |
Hydrogen atoms | 20 |
Heteroatoms | 7 |
N/O atoms | 7 |
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 |