In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 21 | 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) | 2.92 | 6.27 | -35.28 | 2 | 4 | 1 | 44 | 288.367 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.92 | 4.92 | -6.68 | 1 | 4 | 0 | 40 | 287.359 | 7 | ↓ |