In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 15 | 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) | -0.19 | -1.09 | -14.82 | 3 | 5 | 0 | 85 | 310.198 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.19 | -1.35 | -39.22 | 2 | 5 | -1 | 87 | 309.19 | 4 | ↓ |