| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 20 | Yes |
Popular Name: (4S)-N-(4-ethylcyclohexyl)-N-methyl-1,2,3,4-tetrahydroisoquinolin-4-amine (4S)-N-(4-ethylcyclohexyl)-N-met…
| 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) | 3.66 | 7.65 | -33.32 | 2 | 2 | 1 | 16 | 273.444 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.66 | 5.98 | -1.71 | 1 | 2 | 0 | 15 | 272.436 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.66 | 9.01 | -115.25 | 3 | 2 | 2 | 21 | 274.452 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
