In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2010 | 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) | 0.86 | 11 | -27.47 | 1 | 3 | 0 | 45 | 281.355 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.86 | 8.91 | -47.94 | 0 | 3 | -1 | 43 | 280.347 | 4 | ↓ |