CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(CSc3nnc(CN)s3)CS[C@H]12)c1csc(N)n1.Cl.Cl
SMILES: CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(CSc3nnc(CN)s3)CS[C@H]12)c1csc(N)n1.Cl.Cl

Molecular Processing

Molecular formula
C17H20Cl2N8O5S4
Molecular weight
615.57
Exact mass
613.9817
XLogP
0.76
TPSA
199.01
H-bond donors
4
H-bond acceptors
14
Rotatable bonds
9
Heavy atoms
36
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
19
Covalent units
3
Fraction Csp3
0.353
Molar refractivity
142.78

Supplementary Information

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