CCCCO[C@@H]1CN(c2nc(C)c(C(=O)O)s2)CC[C@@H]1NC(=O)c1nc(Cl)c(CC)[nH]1
SMILES: CCCCO[C@@H]1CN(c2nc(C)c(C(=O)O)s2)CC[C@@H]1NC(=O)c1nc(Cl)c(CC)[nH]1

Molecular Processing

Molecular formula
C20H28ClN5O4S
Molecular weight
470
Exact mass
469.1551
XLogP
3.28
TPSA
120.44
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
119.52

Supplementary Information

상세 정보 불러오는 중…

2개 반응에 참여→

확장 검색

부분 구조 검색→유사 구조 검색→