In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 11th, 2006 | 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) | 3.86 | 9.98 | -39.57 | 1 | 3 | 1 | 23 | 286.395 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.86 | 7.62 | -5.75 | 0 | 3 | 0 | 22 | 285.387 | 8 | ↓ |