| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 18 | Yes |
Popular Name: 1-[(3-methylisoxazol-5-yl)methyl]-3,4-dihydro-2H-quinolin-6-amine 1-[(3-methylisoxazol-5-yl)methyl…
| 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) | 1.95 | 5.62 | -9.91 | 2 | 4 | 0 | 55 | 243.31 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.95 | 5.97 | -34.58 | 3 | 4 | 1 | 56 | 244.318 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
