名称: 6-(3-methanesulfonyl-propoxy)-5-methyl-pyrrolo[2,1-f][1,2,4]triazin-4-ol
SMILES:
Cc1c(OCCCS(C)(=O)=O)cn2ncnc(O)c12Molecular Processing
Molecular formula
C11H15N3O4S
Molecular weight
285.33
Exact mass
285.0783
XLogP
0.56
TPSA
93.79
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
69.21
Supplementary Information
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