Br.Br.NCCCSc1nc[nH]n1
SMILES: Br.Br.NCCCSc1nc[nH]n1

Molecular Processing

Molecular formula
C5H12Br2N4S
Molecular weight
320.05
Exact mass
317.9149
XLogP
1.4
TPSA
67.59
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
3
Fraction Csp3
0.6
Molar refractivity
61.42

Supplementary Information

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