| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 20 | Yes |
Popular Name: (4S)-N-ethyl-N-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-4-amine (4S)-N-ethyl-N-(3-fluorophenyl)-…
| 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) | 3.51 | 8.65 | -50.51 | 2 | 2 | 1 | 20 | 271.359 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.51 | 7.33 | -4 | 1 | 2 | 0 | 15 | 270.351 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
