| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 20 | Yes |
Popular Name: (3R)-1-[[1-(difluoromethyl)imidazol-2-yl]methyl]-3,4-dihydro-2H-quinolin-3-amine (3R)-1-[[1-(difluoromethyl)imida…
| 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) | 1.01 | 5.47 | -50.84 | 3 | 4 | 1 | 49 | 279.314 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.01 | 5.16 | -8.79 | 2 | 4 | 0 | 47 | 278.306 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 6.49 | -104.76 | 4 | 4 | 2 | 50 | 280.322 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
