| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 15 | Yes |
Popular Name: (2S)-2-amino-3-[butyl-[(1S)-1-methylpropyl]amino]propanoic (2S)-2-amino-3-[butyl-[(1S)-1-me…
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| 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) | -0.36 | 5.27 | -37.82 | 3 | 4 | 0 | 71 | 216.325 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.36 | 4.53 | -29.45 | 3 | 4 | 0 | 71 | 216.325 | 8 | ↓ |
| Mid Mid (pH 6-8) | -0.36 | 5.76 | -73.05 | 4 | 4 | 1 | 72 | 217.333 | 8 | ↓ |
