| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 18 | Yes |
Popular Name: [2-(3,4-dihydro-2H-quinolin-1-ylmethyl)-3-furyl]methanamine [2-(3,4-dihydro-2H-quinolin-1-yl…
| 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) | 2.32 | 6.04 | -51.58 | 3 | 3 | 1 | 44 | 243.33 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 5.65 | -6.06 | 2 | 3 | 0 | 42 | 242.322 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.32 | 6.59 | -108.96 | 4 | 3 | 2 | 45 | 244.338 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
