SMILES:
Nc1nc(-c2ccc(CCN3CCN(c4nsc5ccccc45)CC3)cc2)cs1Molecular Processing
Molecular formula
C22H23N5S2
Molecular weight
421.6
Exact mass
421.1395
XLogP
4.37
TPSA
58.28
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
29
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
123.94
Supplementary Information
Details werden geladen…
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