In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2008 | 25 | 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) | 1.71 | 6.85 | -16.96 | 0 | 7 | 0 | 63 | 339.399 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.71 | 9.2 | -51.43 | 1 | 7 | 1 | 64 | 340.407 | 3 | ↓ |