Name: 2d
SMILES:
CN(C)c1cccc2c(S(=O)(=O)NC(CCCNC(=O)OCc3ccccc3)C(=O)O)cccc12Molecular Processing
Molecular formula
C25H29N3O6S
Molecular weight
499.59
Exact mass
499.1777
XLogP
3.34
TPSA
125.04
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
35
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.28
Molar refractivity
133.88
Supplementary Information
Details werden geladen…
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