| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 22 | No |
Popular Name: (2S)-4-methyl-2-[[(2R)-3-phenyl-2-(2-sulfanylethylamino)propyl]amino]pentanoic (2S)-4-methyl-2-[[(2R)-3-phenyl-…
| 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) | 1.42 | 9.43 | -89.1 | 4 | 4 | 1 | 73 | 325.498 | 11 | ↓ |
| Hi High (pH 8-9.5) | 1.42 | 8.43 | -47.98 | 3 | 4 | 0 | 69 | 324.49 | 11 | ↓ |
| Hi High (pH 8-9.5) | 1.42 | 8.31 | -36.04 | 3 | 4 | 0 | 69 | 324.49 | 11 | ↓ |
