Название: 6-[4-({4-[(5-Chloro-1H-indol-2-yl)sulphonyl]piperazin-1-yl}carbonyl)phenyl]-pyridazin-3-ol
SMILES:
O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CCN(S(=O)(=O)c2cc3cc(Cl)ccc3[nH]2)CC1Molecular Processing
Molecular formula
C23H20ClN5O4S
Molecular weight
497.96
Exact mass
497.0925
XLogP
3.13
TPSA
119.49
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
34
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
0.174
Molar refractivity
127.1
Supplementary Information
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