| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 19 | No |
Popular Name: (3R,4S)-4-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-1,1-dioxo-thiolan-3-ol (3R,4S)-4-(6-amino-3,4-dihydro-2…
| 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) | 0.21 | 0.04 | -13.22 | 3 | 5 | 0 | 84 | 282.365 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.21 | -0.1 | -51.67 | 4 | 5 | 1 | 85 | 283.373 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.21 | 0.17 | -44.6 | 4 | 5 | 1 | 85 | 283.373 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
