SMILES:
COc1c(C(=O)NCC(=O)O)nc(C#N)c2c(Oc3ccccc3)cccc12Molecular Processing
Molecular formula
C20H15N3O5
Molecular weight
377.36
Exact mass
377.1012
XLogP
2.72
TPSA
121.54
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
99.5
Supplementary Information
Details werden geladen…
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