이름: N-(3-(2-(6-(4-Ethylpiperazin-1-yl)pyridin-3-ylamino)thieno[3,2-d]pyrimidin-7-yl)phenyl)methanesulfonamide
SMILES:
CCN1CCN(c2ccc(Nc3ncc4scc(-c5cccc(NS(C)(=O)=O)c5)c4n3)cn2)CC1Molecular Processing
Molecular formula
C24H27N7O2S2
Molecular weight
509.66
Exact mass
509.1668
XLogP
4.01
TPSA
103.35
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
35
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.292
Molar refractivity
143.16
Supplementary Information
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