Nombre: pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
SMILES:
O=C1Nc2ccccc2Sc2ncccc21Molecular Processing
Molecular formula
C12H8N2OS
Molecular weight
228.28
Exact mass
228.0357
XLogP
2.8
TPSA
41.99
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
16
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
62.76
Supplementary Information
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