SMILES:
Cc1nc(N)nc2c1C(=NOCCCN(C)C)CC(c1ccc(F)cc1-c1cccnc1)C2Molecular Processing
Molecular formula
C25H29FN6O
Molecular weight
448.55
Exact mass
448.2387
XLogP
3.97
TPSA
89.52
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.36
Molar refractivity
127.53
Supplementary Information
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