In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 33 | 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) | 0.72 | 3.59 | -54.5 | 6 | 14 | 1 | 194 | 457.475 | 11 | ↓ |
Hi High (pH 8-9.5) | 0.72 | 1.27 | -25.89 | 5 | 14 | 0 | 193 | 456.467 | 11 | ↓ |