SMILES:
Nc1cccnc1N1CCNCC1Molecular Processing
Molecular formula
C9H14N4
Molecular weight
178.24
Exact mass
178.1218
XLogP
0.07
TPSA
54.18
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
53.73
Supplementary Information
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