SMILES:
CC(=O)Nc1ccc(C=CC2CSC(=O)NN2)cc1Molecular Processing
Molecular formula
C13H15N3O2S
Molecular weight
277.35
Exact mass
277.0885
XLogP
1.99
TPSA
70.23
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
77.69
Supplementary Information
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