| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 18 | Yes |
Popular Name: 2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]thiazole-5-carboxylic 2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-o…
| 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) | 3.08 | 7.73 | -49.75 | 0 | 4 | -1 | 56 | 265.358 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.08 | 8.14 | -36.57 | 1 | 4 | 0 | 58 | 266.366 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
