In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2010 | 14 | 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) | 1.37 | 3.57 | -51.61 | 2 | 3 | 1 | 37 | 231.728 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.37 | 2.28 | -6.34 | 1 | 3 | 0 | 32 | 230.72 | 1 | ↓ |