In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 17 | Yes |
Popular Name: (2R)-2-[(3-hydroxypyridine-2-carbonyl)-methyl-amino]butanoic (2R)-2-[(3-hydroxypyridine-2-car…
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) | -1.02 | 5.7 | -114.7 | 0 | 6 | -2 | 96 | 236.227 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.02 | 3.51 | -101.35 | 1 | 6 | 0 | 98 | 237.235 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.02 | 4.69 | -55.26 | 1 | 6 | -1 | 94 | 237.235 | 4 | ↓ |