SMILES:
Cl.N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CC(=O)O)c4ccccc4)ccc3s2)cc1Molecular Processing
Molecular formula
C24H22ClN5O3S
Molecular weight
495.99
Exact mass
495.1132
XLogP
4.35
TPSA
132.4
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
34
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
2
Fraction Csp3
0.083
Molar refractivity
137.41
Supplementary Information
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