In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 13 | 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) | -0.99 | -1.09 | -118.48 | 6 | 4 | 2 | 74 | 192.303 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.99 | -1.46 | -38.86 | 5 | 4 | 1 | 72 | 191.295 | 8 | ↓ |