SMILES:
ClCc1nnn[nH]1Molecular Processing
Molecular formula
C2H3ClN4
Molecular weight
118.53
Exact mass
118.0046
XLogP
-0.06
TPSA
54.46
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
7
Rings
1
Aromatic rings
1
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
23.73
Supplementary Information
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