SMILES:
CCOC(=O)c1sc(-n2cc3c(n2)CCC(N)C3)nc1CMolecular Processing
Molecular formula
C14H18N4O2S
Molecular weight
306.39
Exact mass
306.115
XLogP
1.63
TPSA
83.03
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
79.93
Supplementary Information
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