| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 18 | Yes |
Popular Name: (1R,2S)-1-(5-chloro-2-thienyl)-N1-ethyl-N1-(2-methoxyethyl)butane-1,2-diamine (1R,2S)-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) | 2.73 | 5.89 | -31.2 | 3 | 3 | 1 | 40 | 291.868 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.73 | 4.08 | -1.65 | 2 | 3 | 0 | 38 | 290.86 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 3.96 | -42.01 | 3 | 3 | 1 | 40 | 291.868 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 6.18 | -103.56 | 4 | 3 | 2 | 41 | 292.876 | 8 | ↓ |
