SMILES:
CCCCCCCCNC(=O)N1CCC(Nc2ccc(CCNC[C@H](O)c3ccc(O)c(NS(C)(=O)=O)c3)cc2)CC1Molecular Processing
Molecular formula
C31H49N5O5S
Molecular weight
603.83
Exact mass
603.3454
XLogP
4.58
TPSA
143.03
H-bond donors
6
H-bond acceptors
7
Rotatable bonds
17
Heavy atoms
42
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.581
Molar refractivity
169.54
Supplementary Information
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