SMILES:
CC[C@@H]1C(=O)N(C)c2cnc(-n3cnc(CCN)c3)nc2N1C1CCCC1Molecular Processing
Molecular formula
C19H27N7O
Molecular weight
369.47
Exact mass
369.2277
XLogP
1.67
TPSA
93.17
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
27
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.579
Molar refractivity
104.14
Supplementary Information
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