이름: 4,6-dichloro-2-(3-isopropoxypropylamino)-5-methylthio-pyrimidine
SMILES:
CSc1c(Cl)nc(NCCCOC(C)C)nc1ClMolecular Processing
Molecular formula
C11H17Cl2N3OS
Molecular weight
310.25
Exact mass
309.0469
XLogP
3.73
TPSA
47.04
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
78.03
Supplementary Information
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