SMILES:
CN1CCN(C2CCC(n3nc(-c4ccc(Nc5nc6ccccc6o5)c(F)c4)c4c(N)ncnc43)CC2)CC1Molecular Processing
Molecular formula
C29H32FN9O
Molecular weight
541.64
Exact mass
541.2714
XLogP
4.83
TPSA
114.16
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
5
Heavy atoms
40
Rings
7
Aromatic rings
5
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.379
Molar refractivity
152.78
Supplementary Information
Details werden geladen…
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