SMILES:
Cc1ccc2c(c1)nc(N)c1ncc(CCc3ccc(C#N)cc3)cc12Molecular Processing
Molecular formula
C22H18N4
Molecular weight
338.41
Exact mass
338.1531
XLogP
4.33
TPSA
75.59
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
26
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.136
Molar refractivity
104.76
Supplementary Information
Details werden geladen…
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