SMILES:
CC(C)Nc1cc(Nc2ccc3ncsc3c2)ncc1-c1nc(C(C)(C)O)c(C(C)C)o1Molecular Processing
Molecular formula
C24H29N5O2S
Molecular weight
451.6
Exact mass
451.2042
XLogP
6.26
TPSA
96.1
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
130.73
Supplementary Information
Details werden geladen…
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