Nombre: hydrochloride
SMILES:
CNC1CCC(Oc2ncnc3sc4c(c23)[C@@H](COCC(N)=O)CC4)CC1.ClMolecular Processing
Molecular formula
C19H27ClN4O3S
Molecular weight
426.97
Exact mass
426.1492
XLogP
2.55
TPSA
99.36
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.632
Molar refractivity
111.47
Supplementary Information
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