| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 17 | Yes |
Popular Name: 4-[methyl-[(1S)-1-(4-pyridyl)ethyl]amino]-4-oxo-butanoic 4-[methyl-[(1S)-1-(4-pyridyl)eth…
| 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) | 0.12 | 6.32 | -47.61 | 0 | 5 | -1 | 73 | 235.263 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.12 | 6.77 | -66.67 | 1 | 5 | 0 | 75 | 236.271 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.12 | 4.8 | -39.99 | 2 | 5 | 1 | 72 | 237.279 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.12 | 4.35 | -10.13 | 1 | 5 | 0 | 71 | 236.271 | 5 | ↓ |
