SMILES:
C[C@@H]1COCCN1c1nc(-c2ccnc(-c3ccccc3)n2)cc(=O)n1CMolecular Processing
Molecular formula
C20H21N5O2
Molecular weight
363.42
Exact mass
363.1695
XLogP
2.13
TPSA
73.14
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
27
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
103.57
Supplementary Information
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