| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2010 | 26 | Yes |
Popular Name: N-[(2R)-2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-4-oxo-1H-quinoline-2-carboxamide N-[(2R)-2-(dimethylamino)-2-(3-f…
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| 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) | 2.06 | 5.85 | -12.21 | 2 | 5 | 0 | 65 | 353.397 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 8.38 | -53.28 | 3 | 5 | 1 | 66 | 354.405 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
