SMILES:
CC=CCNc1ccncc1Molecular Processing
Molecular formula
C9H12N2
Molecular weight
148.21
Exact mass
148.1
XLogP
2.07
TPSA
24.92
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
47.54
Supplementary Information
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