SMILES:
O=C(CCn1nc(-c2ccccc2)c2cnccc21)c1ncc[nH]1Molecular Processing
Molecular formula
C18H15N5O
Molecular weight
317.35
Exact mass
317.1277
XLogP
3.09
TPSA
76.46
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
24
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
90.5
Supplementary Information
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