이름: 1-(3-(1H-pyrrol-1-yl)phenyl)-2-oxopyrrolidine-3-carboxylic acid 1-(3-(1H-pyrrol-1-yl)phenyl)-2-oxopyrrolidine-3-carboxylic acid
SMILES:
O=C(O)C1CCN(c2cccc(-n3cccc3)c2)C1=O.O=C(O)C1CCN(c2cccc(-n3cccc3)c2)C1=OMolecular Processing
Molecular formula
C30H28N4O6
Molecular weight
540.58
Exact mass
540.2009
XLogP
3.83
TPSA
125.08
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
40
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
2
Fraction Csp3
0.2
Molar refractivity
147.73
Supplementary Information
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