In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2008 | 22 | 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) | 1.39 | 5.12 | -20.25 | 3 | 4 | 0 | 72 | 294.354 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.55 | 2.07 | -34.97 | 4 | 4 | 1 | 78 | 295.362 | 3 | ↓ |