In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: (2R)-2-amino-N-(2-methoxyethyl)-N-(2-pyridylmethyl)butanediamide (2R)-2-amino-N-(2-methoxyethyl)-…
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) | -1.04 | -0.63 | -40.25 | 5 | 7 | 1 | 113 | 281.336 | 8 | ↓ |
Hi High (pH 8-9.5) | -1.04 | -0.97 | -12.44 | 4 | 7 | 0 | 112 | 280.328 | 8 | ↓ |
Lo Low (pH 4.5-6) | -1.04 | -0.41 | -87.97 | 6 | 7 | 2 | 114 | 282.344 | 8 | ↓ |