| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 19 | Yes |
Popular Name: N-[[2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]thiazol-5-yl]methyl]ethanamine N-[[2-[(4aR,8aS)-3,4,4a,5,6,7,8,…
| 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) | 3.44 | 9.13 | -37.25 | 2 | 3 | 1 | 33 | 280.461 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 7.76 | -4.04 | 1 | 3 | 0 | 28 | 279.453 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
