MCULE-6692975244-0
- InChIKey:
- SMILES:
- InChI:
- Formula:
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MCULE-4823253805-0
- Component type: Counter Ion
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MCULE-2371875256-1
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MCULE-8888650750-0
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MCULE-1120571851-0
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MCULE-9638104352-0
- Component type: Counter Ion
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MCULE-2368942907-0
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MCULE-4087594267-0
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MCULE-1953589364-0
- Component type: Counter Ion
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MCULE-3376015511-0
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MCULE-4795334272-0
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MCULE-1981947370-0
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MCULE-8294825497-0
- Component type: Counter Ion
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MCULE-5708820011-0
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MCULE-5745113742-0
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MCULE-2821230050-0
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MCULE-7897107590-0
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MCULE-4055374614-0
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MCULE-4807452955-0
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MCULE-8960570445-0
- Component type: Counter Ion
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MCULE-9240208696-0
- Component type: Counter Ion
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MCULE-7342447259-0
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MCULE-8793648213-0
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MCULE-9469904257-0
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MCULE-7278037816-0
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MCULE-4454720933-0
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MCULE-2615386204-0
- Component type: Counter Ion
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MCULE-4744418277-0
- Component type: Counter Ion
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MCULE-1019010343-0
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MCULE-6860791802-0
- Component type: Counter Ion
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MCULE-6206983882-0
- Component type: Counter Ion
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MCULE-4758816351-0
- Component type: Counter Ion
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MCULE-2457790340-1
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MCULE-1827076810-1
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-6692975244-0.sdf |
SMILES | MCULE-6692975244-0.smiles |
Standard InChI | MCULE-6692975244-0.inchi |
InChIKey | MCULE-6692975244-0.txt |
Property | Value |
---|---|
Components | 1 |
Mass | 102.198 |
logP | -0.069 |
H-bond acceptors | 1 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 4.44 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 35.1097 |
Atoms | 23 |
Rings | 0 |
Heavy atoms | 7 |
Hydrogen atoms | 16 |
Heteroatoms | 1 |
N/O atoms | 1 |
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 |