| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 20 | No |
Popular Name: (3S)-3-[[5-(difluoromethylsulfanylmethyl)-2-furyl]methylamino]azepan-2-one (3S)-3-[[5-(difluoromethylsulfan…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.05 | 5.59 | -45.6 | 3 | 4 | 1 | 59 | 305.37 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 5.23 | -10.35 | 2 | 4 | 0 | 54 | 304.362 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
