Name: 3-(4-benzyl-2-methylpiperazin-1-yl)-6-(4-fluorophenyl)-4,5-dimethylpyridazine
SMILES:
Cc1c(-c2ccc(F)cc2)nnc(N2CCN(Cc3ccccc3)CC2C)c1CMolecular Processing
Molecular formula
C24H27FN4
Molecular weight
390.51
Exact mass
390.222
XLogP
4.61
TPSA
32.26
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
115.43
Supplementary Information
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