In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 19 | Yes |
Popular Name: 4-[[6-[[(2R)-2-hydroxypropyl]amino]-3-pyridyl]amino]-4-oxo-butanoic 4-[[6-[[(2R)-2-hydroxypropyl]ami…
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) | -0.24 | 0.3 | -52.8 | 3 | 7 | -1 | 114 | 266.277 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.24 | 0.76 | -72.59 | 4 | 7 | 0 | 116 | 267.285 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.24 | -0.36 | -46.68 | 5 | 7 | 1 | 113 | 268.293 | 7 | ↓ |