SMILES:
COC(=O)CCc1ccc(CCc2cnc3c(N)nc4cc(C)ccc4c3c2)cc1Molecular Processing
Molecular formula
C25H25N3O2
Molecular weight
399.49
Exact mass
399.1947
XLogP
4.56
TPSA
78.1
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.24
Molar refractivity
120.38
Supplementary Information
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