SMILES:
CCNc1nc2ccc(-c3ccc4c(c3)CN(c3nc(C)nc5cc(OCC)ccc35)CCO4)cc2[nH]1Molecular Processing
Molecular formula
C29H30N6O2
Molecular weight
494.6
Exact mass
494.243
XLogP
5.71
TPSA
88.19
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
37
Rings
6
Aromatic rings
5
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.276
Molar refractivity
147.68
Supplementary Information
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