SMILES:
COc1nccc(C)c1-c1ccc2cc(N)ncc2c1Molecular Processing
Molecular formula
C16H15N3O
Molecular weight
265.32
Exact mass
265.1215
XLogP
3.2
TPSA
61.03
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
80.68
Supplementary Information
Details werden geladen…
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