Name: 3,5-Diamino-6-chloro-pyrazine-2-carboxylic acid [1,3,8-triaza-spiro[4.5]dec-(2E)-ylidene]-amide dihydrochloride
SMILES:
Cl.Cl.Nc1nc(N)c(C(=O)/N=C2\NCC3(CCNCC3)N2)nc1ClMolecular Processing
Molecular formula
C12H19Cl3N8O
Molecular weight
397.7
Exact mass
396.0747
XLogP
-0.05
TPSA
143.34
H-bond donors
5
H-bond acceptors
6
Rotatable bonds
1
Heavy atoms
24
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
3
Fraction Csp3
0.5
Molar refractivity
98.1
Supplementary Information
Details werden geladen…
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