CC(=O)Nc1ccc2[nH]c(C(=O)O)cc2c1
Name: 5-(acetylamino)-1H-indole-2-carboxylic acid
SMILES: CC(=O)Nc1ccc2[nH]c(C(=O)O)cc2c1

Molecular Processing

Molecular formula
C11H10N2O3
Molecular weight
218.21
Exact mass
218.0691
XLogP
1.82
TPSA
82.19
H-bond donors
3
H-bond acceptors
2
Rotatable bonds
2
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
59.56

Supplementary Information

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