In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 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) | 4.84 | 10.22 | -5.6 | 0 | 3 | 0 | 22 | 339.479 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.84 | 12.51 | -39.35 | 1 | 3 | 1 | 23 | 340.487 | 9 | ↓ |