In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 16 | Yes |
Popular Name: (2R,3S)-2-amino-1-[(3R)-3-ethylmorpholin-4-yl]-3-methyl-pentan-1-one (2R,3S)-2-amino-1-[(3R)-3-ethylm…
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 | 2.52 | -43.73 | 3 | 4 | 1 | 57 | 229.344 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.86 | 2.19 | -6.38 | 2 | 4 | 0 | 56 | 228.336 | 4 | ↓ |