SMILES:
O=C(O)c1ccc(C#Cc2ccc(C3(NCc4ccccc4)CC3)cc2)cc1Molecular Processing
Molecular formula
C25H21NO2
Molecular weight
367.45
Exact mass
367.1572
XLogP
4.56
TPSA
49.33
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.16
Molar refractivity
110.02
Supplementary Information
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