SMILES:
O=C1OC2(CCN(C(=O)C3(c4ccc(N5CCCC5)nc4)CC3)C2)c2ccncc21Molecular Processing
Molecular formula
C23H24N4O3
Molecular weight
404.47
Exact mass
404.1848
XLogP
2.41
TPSA
75.63
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
30
Rings
6
Aromatic rings
2
Saturated rings
3
Aliphatic rings
4
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.478
Molar refractivity
109.12
Supplementary Information
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