In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 28th, 2008 | 26 | 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) | 2.56 | 9.78 | -46.56 | 1 | 5 | 1 | 43 | 375.514 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 7.55 | -13.9 | 0 | 5 | 0 | 42 | 374.506 | 6 | ↓ |