SMILES:
COc1cc(-c2csc3c(NS(=O)(=O)c4ccccc4)cnc(N)c23)ccc1NC(=O)c1cc2ccccc2n1CMolecular Processing
Molecular formula
C30H25N5O4S2
Molecular weight
583.7
Exact mass
583.1348
XLogP
6.1
TPSA
128.34
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
41
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
164.14
Supplementary Information
Details werden geladen…
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