이름: (S)-2-[4-(3-chloro-2,6-difluoro-phenoxy)-2-oxo-2,5-dihydro-pyrrol-1-yl]-3-cyclohexyl-N-[1-((R)-2,3-dihydroxy-propyl)-1H-pyrazol-3-yl]-propionamide
SMILES:
O=C(Nc1ccn(C[C@@H](O)CO)n1)[C@H](CC1CCCCC1)N1CC(Oc2c(F)ccc(Cl)c2F)=CC1=OMolecular Processing
Molecular formula
C25H29ClF2N4O5
Molecular weight
538.98
Exact mass
538.1795
XLogP
3.25
TPSA
116.92
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
37
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.48
Molar refractivity
130.72
Supplementary Information
상세 정보 불러오는 중…
1개 반응에 참여→