| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-N-[[3-(aminomethyl)benzofuran-2-yl]methyl]-N,2-dimethyl-cyclohexanamine (1S,2S)-N-[[3-(aminomethyl)benzo…
| 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) | 3.56 | 8.37 | -114.87 | 4 | 3 | 2 | 45 | 288.435 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.56 | 7.97 | -32.43 | 3 | 3 | 1 | 44 | 287.427 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
