이름: alcohol
SMILES:
OCCCc1ncnn1C(c1ccccc1)(c1ccccc1)c1ccccc1Molecular Processing
Molecular formula
C24H23N3O
Molecular weight
369.47
Exact mass
369.1841
XLogP
4.04
TPSA
50.94
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
28
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
110.03
Supplementary Information
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