| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: (1R,2R)-1-(5-chloro-2-thienyl)-N1-methyl-N1-[(1S)-1-(2-thienyl)ethyl]propane-1,2-diamine (1R,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) | 3.69 | 5.28 | -42.61 | 3 | 2 | 1 | 31 | 315.915 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.69 | 4.97 | -2.99 | 2 | 2 | 0 | 29 | 314.907 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.69 | 6.43 | -33.23 | 3 | 2 | 1 | 30 | 315.915 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.69 | 6.75 | -105.47 | 4 | 2 | 2 | 32 | 316.923 | 5 | ↓ |
