SMILES:
COc1cc(CN(Cc2nc3ccccc3[nH]2)C2CCCc3cccnc32)ccc1CNMolecular Processing
Molecular formula
C26H29N5O
Molecular weight
427.55
Exact mass
427.2372
XLogP
4.51
TPSA
80.06
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
32
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
126.14
Supplementary Information
Obteniendo detalles…
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