| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 17 | Yes |
Popular Name: 3-[(1S)-1,2,3,4-tetrahydroisoquinolin-1-yl]pyridin-2-amine 3-[(1S)-1,2,3,4-tetrahydroisoqui…
| 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) | 1.80 | 5.19 | -44.11 | 4 | 3 | 1 | 56 | 226.303 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 4.34 | -31.88 | 4 | 3 | 1 | 52 | 226.303 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 5.66 | -99.9 | 5 | 3 | 2 | 57 | 227.311 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 3.88 | -4.94 | 3 | 3 | 0 | 51 | 225.295 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
