| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 19 | Yes |
Popular Name: [(3S)-3-amino-3,4-dihydro-2H-quinolin-1-yl]-(3-bromo-2-thienyl)methanone [(3S)-3-amino-3,4-dihydro-2H-qui…
| 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) | 2.56 | 5.65 | -66.42 | 3 | 3 | 1 | 48 | 338.25 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.56 | 5.33 | -10.03 | 2 | 3 | 0 | 46 | 337.242 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
