SMILES:
Nc1ccc2oc3c(c2c1)CCCCC3Molecular Processing
Molecular formula
C13H15NO
Molecular weight
201.27
Exact mass
201.1154
XLogP
3.28
TPSA
39.16
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
15
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
61.89
Supplementary Information
Details werden geladen…
An 25 Reaktionen beteiligt→