In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 14 | No |
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) | 0.78 | 7.05 | -18.32 | 0 | 3 | 0 | 37 | 211.286 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.52 | 6.99 | -48.04 | 0 | 3 | -1 | 43 | 210.278 | 3 | ↓ |