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Reference:
indigo
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Reference:
Properties
Molecular Weight
180.16 g/mol
Heavy Atoms
13
Rings
1
Rotatable Bonds
3
HB acceptor/donor
4 / 1
Topo. Polar Surface Area
63.6 Ų
Mol Refractivity
44.71
clogP
1.01
Reference:
rdkit
Identifier
Query
aspirin
Formula
C
9
H
8
O
4
Name
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SMILES
SELFIES
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InChI
InChI Key
Reference:
KHN2020
References
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C9H8O4