MCULE-7145992312-0
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- InChI:
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1
MCULE-4801748188-0
- Component type: Unknown
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1
MCULE-6096209142-0
- Component type: Unknown
Name | File |
---|---|
SDF | MCULE-7145992312-0.sdf |
SMILES | MCULE-7145992312-0.smiles |
Standard InChI | MCULE-7145992312-0.inchi |
InChIKey | MCULE-7145992312-0.txt |
Property | Value |
---|---|
Components | 2 |
Mass | 1219.102 |
logP | -2.2463 |
H-bond acceptors | 30 |
H-bond donors | 16 |
Rotatable bonds | 14 |
PSA | 472.49 |
RO5 violations | 3 |
RO3 violations | 5 |
Refractivity | 285.2311 |
Atoms | 152 |
Rings | 10 |
Heavy atoms | 86 |
Hydrogen atoms | 66 |
Heteroatoms | 30 |
N/O atoms | 30 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 11 |
R/S chiral centers | 11 |
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 |