SMILES:
O=c1[nH]c(NCCSSCCNc2ncc(Cc3cccnc3)c(=O)[nH]2)ncc1Cc1cccnc1Molecular Processing
Molecular formula
C24H26N8O2S2
Molecular weight
522.66
Exact mass
522.162
XLogP
2.73
TPSA
141.34
H-bond donors
4
H-bond acceptors
10
Rotatable bonds
13
Heavy atoms
36
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
145.7
Supplementary Information
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