| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 18 | Yes |
Popular Name: (4S)-N-methyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-4-amine (4S)-N-methyl-N-[[(2S)-tetrahydr…
| 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) | 1.67 | 5.41 | -30.24 | 2 | 3 | 1 | 26 | 247.362 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 3.59 | -3.18 | 1 | 3 | 0 | 24 | 246.354 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 4.91 | -42.52 | 2 | 3 | 1 | 29 | 247.362 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
