P-892342162
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Name | File |
---|---|
SDF | P-892342162.sdf |
SMILES | P-892342162.smiles |
Standard InChI | P-892342162.inchi |
InChIKey | P-892342162.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-892342162 | TargetMol | Screening Compounds - stock amount | 95 | unavailable |
Property | Value |
---|---|
Components | 2 |
Mass | 584.518 |
logP | 2.8843 |
H-bond acceptors | 11 |
H-bond donors | 3 |
Rotatable bonds | 10 |
PSA | 164.87 |
RO5 violations | 2 |
RO3 violations | 4 |
Refractivity | 150.2036 |
Atoms | 69 |
Rings | 4 |
Heavy atoms | 38 |
Hydrogen atoms | 31 |
Heteroatoms | 14 |
N/O atoms | 11 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
Chiral centers | 3 |
R/S chiral centers | 3 |
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 |