| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 16 | Yes |
Popular Name: (2S)-2-amino-3-[isopropyl(2-thienylmethyl)amino]propanoic (2S)-2-amino-3-[isopropyl(2-thie…
| 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) | -1.03 | 3.65 | -32.44 | 3 | 4 | 0 | 71 | 242.344 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.03 | 2.89 | -42.05 | 2 | 4 | -1 | 69 | 241.336 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.03 | 4.93 | -41.8 | 3 | 4 | 0 | 71 | 242.344 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.03 | 5.28 | -80.42 | 4 | 4 | 1 | 72 | 243.352 | 6 | ↓ |
