SMILES:
COc1cc(OC)nc(N2CCC3(CC2)OCC(Cn2nnc4ccccc42)O3)n1Molecular Processing
Molecular formula
C20H24N6O4
Molecular weight
412.45
Exact mass
412.1859
XLogP
1.65
TPSA
96.65
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
5
Heavy atoms
30
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
107.67
Supplementary Information
詳細情報を取得中…
1 件の反応に参加→