SMILES:
COc1ccnc(CCc2nc3cc(-c4ccc(S(=O)(=O)Nc5ccccc5OC)cc4)cnc3[nH]2)c1Molecular Processing
Molecular formula
C27H25N5O4S
Molecular weight
515.6
Exact mass
515.1627
XLogP
4.62
TPSA
119.09
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
37
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.148
Molar refractivity
141.32
Supplementary Information
Details werden geladen…
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