In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 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) | 1.52 | -6.18 | -15.79 | 3 | 5 | 0 | 89 | 276.317 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.52 | -5.6 | -46.53 | 2 | 5 | -1 | 91 | 275.309 | 4 | ↓ |