In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 37 | 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) | 4.57 | 13.1 | -14.56 | 2 | 6 | 0 | 74 | 498.671 | 10 | ↓ |
Lo Low (pH 4.5-6) | 4.57 | 13.55 | -46.08 | 3 | 6 | 1 | 76 | 499.679 | 10 | ↓ |