P-675529711
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Name | File |
---|---|
SDF | P-675529711.sdf |
SMILES | P-675529711.smiles |
Standard InChI | P-675529711.inchi |
InChIKey | P-675529711.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-675529711 | Innovapharm | Virtual Screening Compounds | 90 | by synthesis |
Property | Value |
---|---|
Components | 2 |
Mass | 270.150 |
logP | -0.2081 |
H-bond acceptors | 8 |
H-bond donors | 0 |
Rotatable bonds | 4 |
PSA | 123.33 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 64.9865 |
Atoms | 27 |
Rings | 2 |
Heavy atoms | 20 |
Hydrogen atoms | 7 |
Heteroatoms | 9 |
N/O atoms | 8 |
Inorganic atoms | 1 |
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 |