SMILES:
CC(=O)Oc1ccc2ncnc(N[C@H](C)c3ccccc3)c2c1Molecular Processing
Molecular formula
C18H17N3O2
Molecular weight
307.35
Exact mass
307.1321
XLogP
3.73
TPSA
64.11
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
89.33
Supplementary Information
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