Name: 1-isobutyl-3-methylthiourea
SMILES:
CNC(=S)NCC(C)CMolecular Processing
Molecular formula
C6H14N2S
Molecular weight
146.26
Exact mass
146.0878
XLogP
0.74
TPSA
24.06
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
44.5
Supplementary Information
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