In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-N-[2-(diethylamino)-2-oxo-ethyl]-N-methyl-butanediamide (2S)-2-amino-N-[2-(diethylamino)…
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) | -1.14 | -0.74 | -40.05 | 5 | 7 | 1 | 111 | 259.33 | 7 | ↓ |
Hi High (pH 8-9.5) | -1.14 | -1.07 | -14.77 | 4 | 7 | 0 | 110 | 258.322 | 7 | ↓ |