名称: ziprasidone hydrochloride
SMILES:
Cl.O=C1Cc2cc(CCN3CCN(c4nsc5ccccc45)CC3)c(Cl)cc2N1Molecular Processing
Molecular formula
C21H22Cl2N4OS
Molecular weight
449.41
Exact mass
448.0891
XLogP
4.23
TPSA
48.47
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
29
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.333
Molar refractivity
123.01
Supplementary Information
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