이름: 1-(3,5-Diamino-6-chloropyrazinoyl)-2-methylisothiourea hydriodide
SMILES:
CSC(=N)NC(=O)c1nc(Cl)c(N)nc1N.IMolecular Processing
Molecular formula
C7H10ClIN6OS
Molecular weight
388.62
Exact mass
387.937
XLogP
0.94
TPSA
130.77
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
1
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
2
Fraction Csp3
0.143
Molar refractivity
79.99
Supplementary Information
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