In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 21 | 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) | 1.68 | 10.58 | -46.04 | 0 | 3 | -1 | 57 | 285.294 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.68 | 8.6 | -11.27 | 1 | 3 | 0 | 54 | 286.302 | 6 | ↓ |