SMILES:
CCN(CC)CCCn1nc(N)c2c(Cl)cccc21Molecular Processing
Molecular formula
C14H21ClN4
Molecular weight
280.8
Exact mass
280.1455
XLogP
3
TPSA
47.08
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
81.56
Supplementary Information
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