이름: (S)—N-(3-(4-((1-(5-Methyl-4-oxo-3-phenyl-3,4-dihydropyrrolo[2,1-f][1,2,4]triazin-2-yl)ethyl)amino)-7-((2-(trimethylsilyl)ethoxy)methyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)phenyl)methanesulfonamide
SMILES:
Cc1ccn2nc([C@H](C)Nc3ncnc4c3c(-c3cccc(NS(C)(=O)=O)c3)cn4COCC[Si](C)(C)C)n(-c3ccccc3)c(=O)c12Molecular Processing
Molecular formula
C34H40N8O4SSi
Molecular weight
684.9
Exact mass
684.2662
XLogP
6.06
TPSA
137.44
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
12
Heavy atoms
48
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
193.1
Supplementary Information
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