In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2009 | 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) | 6.55 | 13.72 | -43.24 | 0 | 2 | -1 | 40 | 283.476 | 14 | ↓ |
Lo Low (pH 4.5-6) | 6.55 | 11.74 | -4.8 | 1 | 2 | 0 | 37 | 284.484 | 14 | ↓ |