名称: compound
SMILES:
O=c1c2cc(N3CCNCC3)ccc2cnn1Cc1ccccc1Molecular Processing
Molecular formula
C19H20N4O
Molecular weight
320.4
Exact mass
320.1637
XLogP
1.85
TPSA
50.16
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
24
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
96.63
Supplementary Information
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