In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 21 | Yes |
Popular Name: (2S)-4-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-2-isopropyl-2-methyl-4-oxo-butanoic (2S)-4-[[(1S)-1-(3-chlorophenyl)…
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) | 3.28 | 9.05 | -54.86 | 1 | 4 | -1 | 69 | 310.801 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.28 | 7.09 | -11.35 | 2 | 4 | 0 | 66 | 311.809 | 6 | ↓ |