In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 23 | 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) | 3.58 | 9.93 | -125.73 | 0 | 5 | -2 | 93 | 305.289 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.58 | 10.85 | -57.98 | 1 | 5 | -1 | 94 | 306.297 | 3 | ↓ |