| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 21 | Yes |
Popular Name: (1S)-1-(3,4-dimethylphenyl)-N-[(1S)-1-(4-methylsulfanylphenyl)ethyl]ethanamine (1S)-1-(3,4-dimethylphenyl)-N-[(…
| 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) | 5.27 | 11.72 | -39.76 | 2 | 1 | 1 | 17 | 300.491 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.27 | 10.87 | -3.76 | 1 | 1 | 0 | 12 | 299.483 | 5 | ↓ |
