이름: [4-(3,5-dichloro-phenyl)-2-methoxy-quinolin-6-yl]-(6-chloro-pyridin-3-yl)-(3-methyl-3H-imidazol-4-yl)-methanol
SMILES:
COc1cc(-c2cc(Cl)cc(Cl)c2)c2cc(C(O)(c3ccc(Cl)nc3)c3cncn3C)ccc2n1Molecular Processing
Molecular formula
C26H19Cl3N4O2
Molecular weight
525.82
Exact mass
524.0574
XLogP
6.28
TPSA
73.06
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
35
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.115
Molar refractivity
138.31
Supplementary Information
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