SMILES:
Cn1cc(-c2cc3c(cn2)cnn3-c2cccc(N3CCNC[C@H](O)C3)n2)cn1Molecular Processing
Molecular formula
C20H22N8O
Molecular weight
390.45
Exact mass
390.1917
XLogP
0.99
TPSA
96.92
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
29
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
109.95
Supplementary Information
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