In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2008 | 18 | 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) | 3.73 | 10.37 | -8.72 | 1 | 5 | 0 | 58 | 247.346 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.73 | 10.64 | -29.23 | 2 | 5 | 1 | 59 | 248.354 | 7 | ↓ |