In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-4-[[(2R)-2-hydroxy-2-phenyl-ethyl]amino]-2-isopropyl-2-methyl-4-oxo-butanoic (2S)-4-[[(2R)-2-hydroxy-2-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) | 1.49 | 5.35 | -58.63 | 2 | 5 | -1 | 89 | 292.355 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.49 | 3.32 | -14.05 | 3 | 5 | 0 | 87 | 293.363 | 7 | ↓ |