SMILES:
Cc1cc(C)c(-c2csc(NC(=O)C3Cc4ccccc4N3)n2)c(C)c1Molecular Processing
Molecular formula
C21H21N3OS
Molecular weight
363.49
Exact mass
363.1405
XLogP
4.71
TPSA
54.02
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
26
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
107.95
Supplementary Information
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