Cc1cc2nc(NC(=O)C3CC3c3ccncc3)cc(N3CCC(NC(N)=O)CC3)n2n1
SMILES: Cc1cc2nc(NC(=O)C3CC3c3ccncc3)cc(N3CCC(NC(N)=O)CC3)n2n1

Molecular Processing

Molecular formula
C22H26N8O2
Molecular weight
434.5
Exact mass
434.2179
XLogP
1.81
TPSA
130.54
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
32
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
119.39

Supplementary Information

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