SMILES:
CCCc1ccc2c(Nc3cc(C)ccc3Sc3ccc(NC(C)=O)cc3)ccnc2n1Molecular Processing
Molecular formula
C26H26N4OS
Molecular weight
442.59
Exact mass
442.1827
XLogP
6.74
TPSA
66.91
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.192
Molar refractivity
132.86
Supplementary Information
Details werden geladen…
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