P-502364882
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Name | File |
---|---|
SDF | P-502364882.sdf |
SMILES | P-502364882.smiles |
Standard InChI | P-502364882.inchi |
InChIKey | P-502364882.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-502364882 | TimTec | Building Block Collection | 90 | in stock |
Property | Value |
---|---|
Components | 3 |
Mass | 496.558 |
logP | 2.667 |
H-bond acceptors | 11 |
H-bond donors | 6 |
Rotatable bonds | 8 |
PSA | 164.51 |
RO5 violations | 2 |
RO3 violations | 5 |
Refractivity | 154.1644 |
Atoms | 68 |
Rings | 4 |
Heavy atoms | 36 |
Hydrogen atoms | 32 |
Heteroatoms | 11 |
N/O atoms | 11 |
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 |