CN(C)CCNc1c(F)cccc1C1SC(CC(=O)O)C(=O)N1CCC(C)(C)C
SMILES: CN(C)CCNc1c(F)cccc1C1SC(CC(=O)O)C(=O)N1CCC(C)(C)C

Molecular Processing

Molecular formula
C21H32FN3O3S
Molecular weight
425.57
Exact mass
425.2148
XLogP
3.65
TPSA
72.88
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
29
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.619
Molar refractivity
115.6

Supplementary Information

Details werden geladen…

An 6 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→