SMILES:
Cc1cc(NC(=O)NCCN2CCC(N(C)C(=O)OC(C)(C)C)C2)c2ccccc2n1Molecular Processing
Molecular formula
C23H33N5O3
Molecular weight
427.55
Exact mass
427.2583
XLogP
3.61
TPSA
86.8
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.522
Molar refractivity
122.34
Supplementary Information
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