Cc1sc(C(=O)CCc2ccc(OCC3CO3)c(Cl)c2)c2c1[C@H]1[C@@H](C2)C1(C)C
SMILES: Cc1sc(C(=O)CCc2ccc(OCC3CO3)c(Cl)c2)c2c1[C@H]1[C@@H](C2)C1(C)C

Molecular Processing

Molecular formula
C23H25ClO3S
Molecular weight
416.97
Exact mass
416.1213
XLogP
5.6
TPSA
38.83
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
28
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
3
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.522
Molar refractivity
112.11

Supplementary Information

상세 정보 불러오는 중…

1개 반응에 참여→

확장 검색

부분 구조 검색→유사 구조 검색→