| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: 2-[[(1S,2S)-2-amino-1-(3-methyl-2-thienyl)butyl]-isopropyl-amino]acetamide 2-[[(1S,2S)-2-amino-1-(3-methyl-…
| 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) | 1.35 | 2.51 | -100.24 | 6 | 4 | 2 | 75 | 285.457 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.35 | 0.93 | -44.63 | 5 | 4 | 1 | 74 | 284.449 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.35 | 0.65 | -6.68 | 4 | 4 | 0 | 72 | 283.441 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 2.23 | -31.33 | 5 | 4 | 1 | 74 | 284.449 | 7 | ↓ |
