N#Cc1cc(Cl)cc(Oc2c(Cl)ccc(CNC(=O)c3cc4cc(N)ccc4[nH]3)c2F)c1
SMILES: N#Cc1cc(Cl)cc(Oc2c(Cl)ccc(CNC(=O)c3cc4cc(N)ccc4[nH]3)c2F)c1

Molecular Processing

Molecular formula
C23H15Cl2FN4O2
Molecular weight
469.3
Exact mass
468.0556
XLogP
5.79
TPSA
103.93
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.043
Molar refractivity
121.53

Supplementary Information

Details werden geladen…

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