Name: 4-amino-2-methylsulfanyl-pyrimidine-5-carbonitrile
SMILES:
CSc1ncc(C#N)c(N)n1Molecular Processing
Molecular formula
C6H6N4S
Molecular weight
166.21
Exact mass
166.0313
XLogP
0.65
TPSA
75.59
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
11
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
0.167
Molar refractivity
42.94
Supplementary Information
Details werden geladen…
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