SMILES:
Cc1nc(N)c2nc(C)n(CCOCCNC(=O)NC3CC3c3ccccc3)c2c1CMolecular Processing
Molecular formula
C23H30N6O2
Molecular weight
422.53
Exact mass
422.243
XLogP
2.81
TPSA
107.09
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
121.09
Supplementary Information
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