| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 19 | Yes |
Popular Name: [(3S)-3-amino-3,4-dihydro-2H-quinolin-1-yl]-(1-methylpyrazol-4-yl)methanone [(3S)-3-amino-3,4-dihydro-2H-qui…
| 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) | 0.31 | 3.71 | -60.66 | 3 | 5 | 1 | 66 | 257.317 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.31 | 3.38 | -10.14 | 2 | 5 | 0 | 64 | 256.309 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
