SMILES:
CS(=O)(=O)CCOc1ccc2nccc(Sc3ccc(Nc4nnc(-c5ccc(Cl)cc5)c5ccccc45)cc3)c2c1Molecular Processing
Molecular formula
C32H25ClN4O3S2
Molecular weight
613.16
Exact mass
612.1057
XLogP
7.82
TPSA
94.07
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
42
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.094
Molar refractivity
170.78
Supplementary Information
Details werden geladen…
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