SMILES:
COC(=O)c1ccc2c(c1)C(NC(=O)Cn1ccnc1)c1ccccc1CO2Molecular Processing
Molecular formula
C21H19N3O4
Molecular weight
377.4
Exact mass
377.1376
XLogP
2.47
TPSA
82.45
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
100.77
Supplementary Information
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