이름: [4-(cyclopropylsulfanyl)phenyl](6-methoxy-5-methylpyridin-2-yl)methanone
SMILES:
COc1nc(C(=O)c2ccc(SC3CC3)cc2)ccc1CMolecular Processing
Molecular formula
C17H17NO2S
Molecular weight
299.4
Exact mass
299.098
XLogP
3.88
TPSA
39.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
84.28
Supplementary Information
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