SMILES:
CN(C)CCOc1ccc(N2CCN(Cc3cc4cnc(C#N)nc4n3CC(C)(C)C)CC2)cc1Molecular Processing
Molecular formula
C27H37N7O
Molecular weight
475.64
Exact mass
475.306
XLogP
3.61
TPSA
73.45
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.519
Molar refractivity
139.68
Supplementary Information
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