| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: 2-[[(1R,2S)-2-amino-1-(5-chloro-2-thienyl)butyl]-isopropyl-amino]acetamide 2-[[(1R,2S)-2-amino-1-(5-chloro-…
| 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) | 1.77 | 3.17 | -120.16 | 6 | 4 | 2 | 75 | 305.875 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 1.47 | -44.34 | 5 | 4 | 1 | 74 | 304.867 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 1.12 | -5.52 | 4 | 4 | 0 | 72 | 303.859 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.77 | 2.86 | -36.22 | 5 | 4 | 1 | 74 | 304.867 | 7 | ↓ |
