| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 17 | Yes |
Popular Name: (3S)-3-[[(1R)-1,3-dimethylbutyl]amino]-3-(2-thienyl)propanoic (3S)-3-[[(1R)-1,3-dimethylbutyl]…
| 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) | 3.08 | 8.12 | -28.27 | 2 | 3 | 0 | 57 | 255.383 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.08 | 7.31 | -40.68 | 1 | 3 | -1 | 52 | 254.375 | 7 | ↓ |
