In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2008 | 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) | 1.38 | -4.48 | -27.95 | 3 | 4 | 1 | 59 | 288.758 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.38 | -4.39 | -90.84 | 4 | 4 | 2 | 60 | 289.766 | 3 | ↓ |