SMILES:
FC1(F)CCN(c2cncc(-c3cnc4[nH]ccc4c3)n2)C1Molecular Processing
Molecular formula
C15H13F2N5
Molecular weight
301.3
Exact mass
301.1139
XLogP
2.87
TPSA
57.7
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
78.9
Supplementary Information
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