In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: (2S)-4-[[(1S)-1-(hydroxymethyl)propyl]amino]-2-methyl-4-oxo-2-phenyl-butanoic (2S)-4-[[(1S)-1-(hydroxymethyl)p…
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) | 1.39 | 4.93 | -57.37 | 2 | 5 | -1 | 89 | 278.328 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.39 | 2.9 | -12.73 | 3 | 5 | 0 | 87 | 279.336 | 7 | ↓ |