Name: 2-[(1,2-dimethyl-3-indolyl)carbonyl]-5-dimethylaminobenzoic acid
SMILES:
Cc1c(C(=O)c2ccc(N(C)C)cc2C(=O)O)c2ccccc2n1CMolecular Processing
Molecular formula
C20H20N2O3
Molecular weight
336.39
Exact mass
336.1474
XLogP
3.48
TPSA
62.54
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
98.82
Supplementary Information
Details werden geladen…
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