이름: Compound 31
SMILES:
CCNC[C@@H](Nc1ncnc2c(C(N)=O)ccnc12)c1cc(F)c(OC)cc1FMolecular Processing
Molecular formula
C19H20F2N6O2
Molecular weight
402.41
Exact mass
402.1616
XLogP
2.17
TPSA
115.05
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
103.67
Supplementary Information
상세 정보 불러오는 중…
1개 반응에 참여→