SMILES:
O=C(NC1CN2CCC1CC2)c1cccc2oc(C3CC3)nc12Molecular Processing
Molecular formula
C18H21N3O2
Molecular weight
311.39
Exact mass
311.1634
XLogP
2.53
TPSA
58.37
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
23
Rings
6
Aromatic rings
2
Saturated rings
4
Aliphatic rings
4
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
86.4
Supplementary Information
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