SMILES:
COc1ccc(CC2c3c(OC)ccc(OC)c3CCN2CC(=O)NCc2nc3ccccc3[nH]2)cc1OCMolecular Processing
Molecular formula
C30H34N4O5
Molecular weight
530.63
Exact mass
530.2529
XLogP
4.06
TPSA
97.94
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
10
Heavy atoms
39
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
148.75
Supplementary Information
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