| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 18 | Yes |
Popular Name: (3S)-1-[(5-bromo-3-thienyl)methyl]-3,4-dihydro-2H-quinolin-3-amine (3S)-1-[(5-bromo-3-thienyl)methy…
| 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) | 2.82 | 6.87 | -48.91 | 3 | 2 | 1 | 31 | 324.267 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.82 | 6.56 | -3.94 | 2 | 2 | 0 | 29 | 323.259 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
