COc1ccc(CNc2ccncc2)c2c1OCC2C
SMILES: COc1ccc(CNc2ccncc2)c2c1OCC2C

Molecular Processing

Molecular formula
C16H18N2O2
Molecular weight
270.33
Exact mass
270.1368
XLogP
3.2
TPSA
43.38
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
78.47

Supplementary Information

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