이름: 2-(3-methoxyphenyl)-1,3-thiazole-4-carboxylic acid
SMILES:
COc1cccc(-c2nc(C(=O)O)cs2)c1Molecular Processing
Molecular formula
C11H9NO3S
Molecular weight
235.26
Exact mass
235.0303
XLogP
2.52
TPSA
59.42
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
61.06
Supplementary Information
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