| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 17 | Yes |
Popular Name: (1S,2R)-1-(5-chloro-2-thienyl)-N1-(2-methoxyethyl)-N1-methyl-butane-1,2-diamine (1S,2R)-1-(5-chloro-2-thienyl)-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) | 2.35 | 5.06 | -32.66 | 3 | 3 | 1 | 40 | 277.841 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 3.33 | -3.33 | 2 | 3 | 0 | 38 | 276.833 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 3.56 | -44.22 | 3 | 3 | 1 | 40 | 277.841 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 5.39 | -115.98 | 4 | 3 | 2 | 41 | 278.849 | 7 | ↓ |
