SMILES:
Cc1cc2nc(N[C@@H]3CCCc4ccccc43)[nH]c2cc1CMolecular Processing
Molecular formula
C19H21N3
Molecular weight
291.4
Exact mass
291.1735
XLogP
4.67
TPSA
40.71
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
22
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
91.31
Supplementary Information
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