| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2009 | 19 | Yes |
Popular Name: (4S)-1-methyl-4-(4H-1,2,4-triazol-3-ylmethylamino)-3,4-dihydroquinolin-2-one (4S)-1-methyl-4-(4H-1,2,4-triazo…
| 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) | -1.43 | 5.49 | -46.87 | 3 | 6 | 1 | 78 | 258.305 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.43 | 4.11 | -11.31 | 2 | 6 | 0 | 74 | 257.297 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -1.43 | 5.33 | -37.13 | 2 | 6 | 0 | 77 | 257.297 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
