SMILES:
CCCCc1nc2c(N)nc3cccnc3c2n1CCCCNC(=O)OCCMolecular Processing
Molecular formula
C20H28N6O2
Molecular weight
384.48
Exact mass
384.2274
XLogP
3.43
TPSA
107.95
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
110.11
Supplementary Information
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