SMILES:
NC(Cc1cc(Cl)c2cccnc2c1OCc1ccccc1)c1cccc(CN2CCCC2)c1Molecular Processing
Molecular formula
C29H30ClN3O
Molecular weight
472.03
Exact mass
471.2077
XLogP
6.31
TPSA
51.38
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
34
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.276
Molar refractivity
139.11
Supplementary Information
Details werden geladen…
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