| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 18 | Yes |
Popular Name: (1R,2S)-N1-methyl-1-(3-methyl-2-thienyl)-N1-(2,2,2-trifluoroethyl)butane-1,2-diamine (1R,2S)-N1-methyl-1-(3-methyl-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) | 2.87 | 4.87 | -46.27 | 3 | 2 | 1 | 31 | 281.367 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.87 | 4.58 | -4.3 | 2 | 2 | 0 | 29 | 280.359 | 6 | ↓ |
