| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 22 | Yes |
Popular Name: 3-[[(3S)-3-(dimethylamino)pyrrolidin-1-yl]methyl]-7-methoxy-1H-quinolin-2-one 3-[[(3S)-3-(dimethylamino)pyrrol…
| 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) | 1.07 | 4.62 | -38.72 | 2 | 5 | 1 | 50 | 302.398 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.07 | 2.24 | -9.69 | 1 | 5 | 0 | 49 | 301.39 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.07 | 7.01 | -108.67 | 3 | 5 | 2 | 51 | 303.406 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.07 | 4.63 | -40.28 | 2 | 5 | 1 | 50 | 302.398 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
