In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 19 | 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) | -0.42 | 1.94 | -56.4 | 4 | 6 | 1 | 84 | 264.305 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.42 | 0.6 | -16.35 | 3 | 6 | 0 | 79 | 263.297 | 3 | ↓ |