SMILES:
CC(C)(C)CCNC(=O)c1cccnc1SCCCc1ccc(F)cc1Molecular Processing
Molecular formula
C21H27FN2OS
Molecular weight
374.53
Exact mass
374.1828
XLogP
5.11
TPSA
41.99
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
106.09
Supplementary Information
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