| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 17 | Yes |
Popular Name: 3-[[(1S)-2-amino-1-(5-chloro-2-thienyl)ethyl]-isopropyl-amino]propan-1-ol 3-[[(1S)-2-amino-1-(5-chloro-2-t…
| 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) | 1.74 | 1.26 | -50.35 | 4 | 3 | 1 | 51 | 277.841 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 0.99 | -4.15 | 3 | 3 | 0 | 49 | 276.833 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | 3.05 | -31.18 | 4 | 3 | 1 | 51 | 277.841 | 7 | ↓ |
