Name: 9
SMILES:
CN(C)Cc1cnc2oc3c(N4CCOCC4)nc(Cl)nc3c2c1Molecular Processing
Molecular formula
C16H18ClN5O2
Molecular weight
347.81
Exact mass
347.1149
XLogP
2.32
TPSA
67.52
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
24
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
92.54
Supplementary Information
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