SMILES:
CC(C)n1nc(-c2ccc3c(c2)CCO3)c2c(N)ncnc21Molecular Processing
Molecular formula
C16H17N5O
Molecular weight
295.35
Exact mass
295.1433
XLogP
2.59
TPSA
78.85
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
22
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
84.76
Supplementary Information
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