COc1ncc(F)cc1-c1cc(C=Cc2ccc(N)cn2)c(OC)c(C(C)(C)C)c1
SMILES: COc1ncc(F)cc1-c1cc(C=Cc2ccc(N)cn2)c(OC)c(C(C)(C)C)c1

Molecular Processing

Molecular formula
C24H26FN3O2
Molecular weight
407.49
Exact mass
407.2009
XLogP
5.35
TPSA
70.26
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
119.01

Supplementary Information

Details werden geladen…

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