In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 14 | 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) | 0.67 | 1.2 | -45.58 | 3 | 4 | 1 | 55 | 206.306 | 10 | ↓ |
Hi High (pH 8-9.5) | 0.67 | -0.3 | -7.72 | 2 | 4 | 0 | 51 | 205.298 | 10 | ↓ |