In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 18 | Yes |
Popular Name: (2S)-4-methyl-2-phenyl-2-(prop-2-ynylamino)pentanoic (2S)-4-methyl-2-phenyl-2-(prop-2…
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) | 2.81 | 8.38 | -27.44 | 2 | 3 | 0 | 57 | 245.322 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 8.46 | -45.28 | 1 | 3 | -1 | 52 | 244.314 | 6 | ↓ |