CC(C)(C)C(=O)Nc1nc(O)c2cc(C=CCOC3CCCCO3)cnc2n1
SMILES: CC(C)(C)C(=O)Nc1nc(O)c2cc(C=CCOC3CCCCO3)cnc2n1

Molecular Processing

Molecular formula
C20H26N4O4
Molecular weight
386.45
Exact mass
386.1954
XLogP
3.27
TPSA
106.46
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
28
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
0.5
Molar refractivity
105.66

Supplementary Information

Details werden geladen…

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