SMILES:
COc1cc(-c2csc3c(-c4cccc(N(C)C)c4)cnc(N)c23)ccc1NC(=O)c1cc2ccccc2n1CMolecular Processing
Molecular formula
C32H29N5O2S
Molecular weight
547.68
Exact mass
547.2042
XLogP
7.03
TPSA
85.41
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
40
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
166.66
Supplementary Information
Obteniendo detalles…
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