SMILES:
CCCN(CCO)C(=O)C1=Cc2ccc(-c3ccc(C(=O)N4CCCC4)cc3)cc2N=C(N)C1Molecular Processing
Molecular formula
C27H32N4O3
Molecular weight
460.58
Exact mass
460.2474
XLogP
3.6
TPSA
99.23
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
34
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.37
Molar refractivity
134.85
Supplementary Information
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