In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
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) | 0.10 | 4.64 | -46.89 | 0 | 6 | -1 | 73 | 283.348 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.10 | 6.59 | -73.96 | 1 | 6 | 0 | 74 | 284.356 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.10 | 4.61 | -45.91 | 2 | 6 | 1 | 71 | 285.364 | 5 | ↓ |