In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 15 | Yes |
Popular Name: 4-[[2-[isopropyl(methyl)amino]-2-oxo-ethyl]amino]butanoic 4-[[2-[isopropyl(methyl)amino]-2…
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) | -0.44 | 4.85 | -62.64 | 2 | 5 | 0 | 77 | 216.281 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.44 | 3.5 | -51.92 | 1 | 5 | -1 | 72 | 215.273 | 7 | ↓ |