이름: 6-ethyl-3-(2-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
SMILES:
CCc1cc2c(=O)n(CCc3ccccn3)c(=O)[nH]c2s1Molecular Processing
Molecular formula
C15H15N3O2S
Molecular weight
301.37
Exact mass
301.0885
XLogP
1.95
TPSA
67.75
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
84.02
Supplementary Information
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