P-611521923
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Name | File |
---|---|
SDF | P-611521923.sdf |
SMILES | P-611521923.smiles |
Standard InChI | P-611521923.inchi |
InChIKey | P-611521923.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-611521923 | Toronto Research | In stock | 90 | in stock |
Property | Value |
---|---|
Components | 2 |
Mass | 432.494 |
logP | 0.6702 |
H-bond acceptors | 11 |
H-bond donors | 4 |
Rotatable bonds | 9 |
PSA | 182.58 |
RO5 violations | 1 |
RO3 violations | 5 |
Refractivity | 109.3831 |
Atoms | 57 |
Rings | 2 |
Heavy atoms | 29 |
Hydrogen atoms | 28 |
Heteroatoms | 12 |
N/O atoms | 11 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 1 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 1 |
Undefined stereo double bonds | 0 |