SMILES:
Nc1nc2c(c3c1ncn3Cc1ccccc1)CCCC2Molecular Processing
Molecular formula
C17H18N4
Molecular weight
278.36
Exact mass
278.1531
XLogP
2.94
TPSA
56.73
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
21
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
84.13
Supplementary Information
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