| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 20 | Yes |
Popular Name: (3S)-3-[(1-isobutyl-3-methyl-butyl)amino]-3-(2-thienyl)propanoic (3S)-3-[(1-isobutyl-3-methyl-but…
| 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) | 4.39 | 9.28 | -27.4 | 2 | 3 | 0 | 57 | 297.464 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.39 | 8.76 | -40.05 | 1 | 3 | -1 | 52 | 296.456 | 9 | ↓ |
