In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 21 | Yes |
Popular Name: 4-[[6-[bis(2-hydroxyethyl)amino]-3-pyridyl]amino]-4-oxo-butanoic 4-[[6-[bis(2-hydroxyethyl)amino]…
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) | -0.99 | -0.49 | -57.55 | 3 | 8 | -1 | 126 | 296.303 | 9 | ↓ |
Mid Mid (pH 6-8) | -0.99 | -0.07 | -63.11 | 4 | 8 | 0 | 127 | 297.311 | 9 | ↓ |
Lo Low (pH 4.5-6) | -0.99 | -1.19 | -37.31 | 5 | 8 | 1 | 124 | 298.319 | 9 | ↓ |