In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 20 | Yes |
Popular Name: (2S)-4-[2-cyanoethyl(methyl)amino]-2-methyl-4-oxo-2-phenyl-butanoic (2S)-4-[2-cyanoethyl(methyl)amin…
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) | 0.86 | 8.95 | -61.51 | 0 | 5 | -1 | 84 | 273.312 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.86 | 6.98 | -18.78 | 1 | 5 | 0 | 81 | 274.32 | 6 | ↓ |