In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: (2S)-4-[[(1R)-2-hydroxy-1-methyl-ethyl]amino]-2-methyl-4-oxo-2-phenyl-butanoic (2S)-4-[[(1R)-2-hydroxy-1-methyl…
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) | 0.85 | 3.95 | -59.98 | 2 | 5 | -1 | 89 | 264.301 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.85 | 1.99 | -13.69 | 3 | 5 | 0 | 87 | 265.309 | 6 | ↓ |