이름: 3-(dipropylcarbamoyl)benzoic acid
SMILES:
CCCN(CCC)C(=O)c1cccc(C(=O)O)c1Molecular Processing
Molecular formula
C14H19NO3
Molecular weight
249.31
Exact mass
249.1365
XLogP
2.65
TPSA
57.61
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
69.89
Supplementary Information
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