Name: acid 1i
SMILES:
O=C(Nc1cnc2n(c1=O)[C@H](C(=O)O)CC2)OCc1ccccc1Molecular Processing
Molecular formula
C16H15N3O5
Molecular weight
329.31
Exact mass
329.1012
XLogP
1.56
TPSA
110.52
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
83.74
Supplementary Information
Details werden geladen…
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