SMILES:
N#CCCc1cccc(-c2ccc3cnc(Nc4ccc5c(c4)CCC(N4CCOCC4)CC5)nn23)c1Molecular Processing
Molecular formula
C30H32N6O
Molecular weight
492.63
Exact mass
492.2638
XLogP
5.18
TPSA
78.48
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
37
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.367
Molar refractivity
144.9
Supplementary Information
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