| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 17 | Yes |
Popular Name: (2S)-2-(2-diethylaminoethylamino)-2-(2-thienyl)acetic (2S)-2-(2-diethylaminoethylamino…
| 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) | 1.61 | 6.44 | -48.39 | 2 | 4 | 0 | 57 | 256.371 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 5.41 | -29.57 | 2 | 4 | 0 | 60 | 256.371 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 4.3 | -45.74 | 1 | 4 | -1 | 55 | 255.363 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.61 | 7.55 | -72.89 | 3 | 4 | 1 | 61 | 257.379 | 8 | ↓ |
