SMILES:
O=C1c2ccccc2C(O)N1CCSc1ccncc1Molecular Processing
Molecular formula
C15H14N2O2S
Molecular weight
286.36
Exact mass
286.0776
XLogP
2.32
TPSA
53.43
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
77.4
Supplementary Information
Details werden geladen…
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