SMILES:
O=C(NC1CC1)c1ccc2c(-c3nc4ccccc4[nH]3)n[nH]c2c1Molecular Processing
Molecular formula
C18H15N5O
Molecular weight
317.35
Exact mass
317.1277
XLogP
3
TPSA
86.46
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
24
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
91.67
Supplementary Information
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