Brc1cnc(C2CC2)nc1
SMILES: Brc1cnc(C2CC2)nc1

Molecular Processing

Molecular formula
C7H7BrN2
Molecular weight
199.05
Exact mass
197.9793
XLogP
2.12
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
41.71

Supplementary Information

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