In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 19 | 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) | 2.38 | -2.18 | -13.59 | 1 | 5 | 0 | 82 | 293.735 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.38 | -1.61 | -37.33 | 0 | 5 | -1 | 84 | 292.727 | 3 | ↓ |