Name: compound
SMILES:
CC(C)(C)OC(=O)N(Cc1ccccn1)Cc1ccc(C(=O)O)cn1Molecular Processing
Molecular formula
C18H21N3O4
Molecular weight
343.38
Exact mass
343.1532
XLogP
3.11
TPSA
92.62
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
90.91
Supplementary Information
Details werden geladen…
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