CN(C)Cc1ccc(Cc2cnc(NCCSCc3ccc(CN(C)C)o3)[nH]c2=O)cc1
SMILES: CN(C)Cc1ccc(Cc2cnc(NCCSCc3ccc(CN(C)C)o3)[nH]c2=O)cc1

Molecular Processing

Molecular formula
C24H33N5O2S
Molecular weight
455.63
Exact mass
455.2355
XLogP
3.42
TPSA
77.4
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
12
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
132.25

Supplementary Information

Details werden geladen…

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