In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2004 | 16 | 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) | -0.45 | 5.48 | -206.9 | 1 | 7 | -3 | 141 | 231.18 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.45 | 2.95 | -124.92 | 2 | 7 | -2 | 138 | 232.188 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.45 | 3.5 | -108.38 | 2 | 7 | -2 | 138 | 232.188 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.45 | 0.97 | -54.06 | 3 | 7 | -1 | 135 | 233.196 | 7 | ↓ |