In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2010 | 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) | 1.72 | 3.92 | -10.11 | 0 | 5 | 0 | 55 | 278.352 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.72 | 6.23 | -42.96 | 1 | 5 | 1 | 56 | 279.36 | 10 | ↓ |