Cc1onc(-c2ccccc2)c1-c1nnc(-c2ccc(N3CCCCC3)cc2)o1
SMILES: Cc1onc(-c2ccccc2)c1-c1nnc(-c2ccc(N3CCCCC3)cc2)o1

Molecular Processing

Molecular formula
C23H22N4O2
Molecular weight
386.46
Exact mass
386.1743
XLogP
5.36
TPSA
68.19
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
29
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.261
Molar refractivity
111.47

Supplementary Information

Details werden geladen…

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