SMILES:
COc1cc(Nc2ncc3c(C)nc(-c4cccc(C#Cc5cn[nH]c5)c4)n3n2)cc(OC)c1OCMolecular Processing
Molecular formula
C26H23N7O3
Molecular weight
481.52
Exact mass
481.1862
XLogP
3.99
TPSA
111.48
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
36
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
134.9
Supplementary Information
Obteniendo detalles…
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