SMILES:
Nc1nc(N2CC3CCN(Cc4c(Cl)cccc4Cl)C3C2)nc2nc(-c3ccco3)nn12Molecular Processing
Molecular formula
C21H20Cl2N8O
Molecular weight
471.35
Exact mass
470.1137
XLogP
3.38
TPSA
101.61
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
32
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
121.67
Supplementary Information
상세 정보 불러오는 중…
1개 반응에 참여→