| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 18 | Yes |
Popular Name: 3-methoxy-N-methyl-N-[[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]propan-1-amine 3-methoxy-N-methyl-N-[[(1R)-1,2,…
| 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) | 1.96 | 3.57 | -3.32 | 1 | 3 | 0 | 24 | 248.37 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 5.2 | -36.81 | 2 | 3 | 1 | 29 | 249.378 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 6.02 | -37.24 | 2 | 3 | 1 | 26 | 249.378 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.96 | 7.23 | -123.44 | 3 | 3 | 2 | 30 | 250.386 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
