SMILES:
Cc1ccc2c(c1)N=C(N1CCC(C)CC1)c1cccc3c1N2CC3Molecular Processing
Molecular formula
C22H25N3
Molecular weight
331.46
Exact mass
331.2048
XLogP
4.81
TPSA
18.84
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
25
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
104.5
Supplementary Information
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