SMILES:
COc1ccc2c(c1)c1c(n2C)CCC(Cc2nc[nH]c2C)C1=OMolecular Processing
Molecular formula
C19H21N3O2
Molecular weight
323.4
Exact mass
323.1634
XLogP
3.21
TPSA
59.91
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
24
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
92.64
Supplementary Information
Obteniendo detalles…
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