SMILES:
CC1(O)CCN(c2nc(Cl)nc(NN)c2F)C1Molecular Processing
Molecular formula
C9H13ClFN5O
Molecular weight
261.69
Exact mass
261.0793
XLogP
0.52
TPSA
87.3
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
62.26
Supplementary Information
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