In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 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) | 2.39 | 5.51 | -7.28 | 0 | 4 | 0 | 52 | 237.262 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.39 | 5.97 | -43.05 | 1 | 4 | 1 | 53 | 238.27 | 3 | ↓ |