Name: 6-benzyloxy-4-methyl-1H-indole-2-carboxylic acid
SMILES:
Cc1cc(OCc2ccccc2)cc2[nH]c(C(=O)O)cc12Molecular Processing
Molecular formula
C17H15NO3
Molecular weight
281.31
Exact mass
281.1052
XLogP
3.75
TPSA
62.32
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
80.77
Supplementary Information
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