이름: (R)-N-[5-(1-hydroxy-2-{2-[4-(2-methyl-thiazol-4-yl)-phenoxy]-ethylamino}-ethyl)-pyridin-2-yl]-acetamide
SMILES:
CC(=O)Nc1ccc([C@@H](O)CNCCOc2ccc(-c3csc(C)n3)cc2)cn1Molecular Processing
Molecular formula
C21H24N4O3S
Molecular weight
412.52
Exact mass
412.1569
XLogP
3.17
TPSA
96.37
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
114.15
Supplementary Information
상세 정보 불러오는 중…
4개 반응에 참여→