SMILES:
Cc1nc(-c2cccc(Nc3nc(N[C@@H]4CCCC[C@@H]4N)ncc3C(N)=O)c2)cs1Molecular Processing
Molecular formula
C21H25N7OS
Molecular weight
423.55
Exact mass
423.1841
XLogP
3.43
TPSA
131.84
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
119.97
Supplementary Information
Details werden geladen…
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